1$Basis = Ahlrichs pVDZ 2 3$Elements supported 4$H He Li Be B C N O F Ne Na Mg Al Si P S Cl Ar K Ca Sc Ti V Cr Mn Fe Co Ni Cu 5$Zn Ga Ge As Se Br Kr 6$ 7$ REFERENCES 8$ Elements References 9$ -------- ---------- 10$ H - Kr: A. Schafer, H. Horn and R. Ahlrichs, J. Chem. Phys. 97, 2571 (1992). 11$ 12$ Polarization and/or diffuse functions 13$ Elements References 14$ -------- ---------- 15$ H - Kr: R. Ahlrichs and coworkers, (mostly unpublished) 16$ 17a 1 18$ HYDROGEN (4s) -> [2s] 19$ HYDROGEN (1p) 20$ S-TYPE FUNCTIONS 21 4 2 0 22 13.01070100 0.01968216 0.00000000 23 1.96225720 0.13796524 0.00000000 24 0.44453796 0.47831935 0.00000000 25 0.12194962 0.00000000 1.00000000 26$ P-TYPE FUNCTIONS 27 1 1 0 28 0.80000000 1.00000000 29a 2 30$ HELIUM (4s) -> [2s] 31$ HELIUM (1p) 32$ S-TYPE FUNCTIONS 33 4 2 0 34 38.35493674 0.02381429 0.00000000 35 5.76890815 0.15490907 0.00000000 36 1.23994070 0.46998097 0.00000000 37 0.29757816 0.00000000 1.00000000 38$ P-TYPE FUNCTIONS 39 1 1 0 40 1.00000000 1.00000000 41a 3 42$ LITHIUM (7s) -> [3s] 43$ LITHIUM (1p) 44$ S-TYPE FUNCTIONS 45 7 3 0 46 266.27785520 0.00649202 0.00000000 0.00000000 47 40.06978345 0.04774786 0.00000000 0.00000000 48 9.05599444 0.20268796 0.00000000 0.00000000 49 2.45030091 0.48606575 0.00000000 0.00000000 50 0.72209572 0.43626978 0.00000000 0.00000000 51 0.52810885 0.00000000 1.00000000 0.00000000 52 0.20960949 0.00000000 0.00000000 1.00000000 53$ P-TYPE FUNCTIONS 54 1 1 0 55 0.17000000 1.00000000 56a 4 57$ BERYLLIUM (7s) -> [3s] 58$ BERYLLIUM (2p) 59$ S-TYPE FUNCTIONS 60 7 3 0 61 515.18616130 0.00556153 0.00000000 0.00000000 62 77.51103760 0.04119007 0.00000000 0.00000000 63 17.55248169 0.17913378 0.00000000 0.00000000 64 4.80289406 0.44736716 0.00000000 0.00000000 65 1.45162143 0.42009582 0.00000000 0.00000000 66 0.13281634 0.00000000 1.00000000 0.00000000 67 0.45837372 0.00000000 0.00000000 1.00000000 68$ P-TYPE FUNCTIONS 69 4 2 0 70 3.63169172 -0.02903400 0.00000000 71 0.71695694 -0.16877854 0.00000000 72 0.19541933 -0.51403420 0.00000000 73 0.60515466 0.00000000 1.00000000 74a 5 75$ BORON (7s,4p) -> [3s,2p] 76$ BORON (1d) 77$ S-TYPE FUNCTIONS 78 7 3 0 79 839.31830090 -0.00559292 0.00000000 0.00000000 80 126.26464840 -0.04156552 0.00000000 0.00000000 81 28.62060076 -0.18299817 0.00000000 0.00000000 82 7.87937227 -0.46540392 0.00000000 0.00000000 83 2.40888572 -0.44173885 0.00000000 0.00000000 84 0.25105109 0.00000000 1.00000000 0.00000000 85 0.83648866 0.00000000 0.00000000 1.00000000 86$ P-TYPE FUNCTIONS 87 4 2 0 88 6.03322236 -0.03560367 0.00000000 89 1.24991579 -0.19895776 0.00000000 90 0.33871676 -0.50850203 0.00000000 91 0.96415632 0.00000000 1.00000000 92$ D-TYPE FUNCTIONS 93 1 1 0 94 0.50000000 1.00000000 95a 6 96$ CARBON (7s,4p) -> [3s,2p] 97$ CARBON (1d) 98$ S-TYPE FUNCTIONS 99 7 3 0 100 1238.40169400 0.00545688 0.00000000 0.00000000 101 186.29004990 0.04063841 0.00000000 0.00000000 102 42.25117635 0.18025594 0.00000000 0.00000000 103 11.67655793 0.46315122 0.00000000 0.00000000 104 3.59305065 0.44087173 0.00000000 0.00000000 105 0.40245147 0.00000000 1.00000000 0.00000000 106 0.13090183 0.00000000 0.00000000 1.00000000 107$ P-TYPE FUNCTIONS 108 4 2 0 109 9.46809706 0.03838787 0.00000000 110 2.01035451 0.21117025 0.00000000 111 0.54771005 0.51328172 0.00000000 112 0.15268614 0.00000000 1.00000000 113$ D-TYPE FUNCTIONS 114 1 1 0 115 0.80000000 1.00000000 116a 7 117$ NITROGEN (7s,4p) -> [3s,2p] 118$ NITROGEN (1d) 119$ S-TYPE FUNCTIONS 120 7 3 0 121 1712.84158500 -0.00539341 0.00000000 0.00000000 122 257.64812680 -0.04022158 0.00000000 0.00000000 123 58.45824585 -0.17931145 0.00000000 0.00000000 124 16.19836791 -0.46376318 0.00000000 0.00000000 125 5.00526008 -0.44171423 0.00000000 0.00000000 126 0.58731857 0.00000000 1.00000000 0.00000000 127 0.18764592 0.00000000 0.00000000 1.00000000 128$ P-TYPE FUNCTIONS 129 4 2 0 130 13.57147023 -0.04007240 0.00000000 131 2.92573729 -0.21807045 0.00000000 132 0.79927751 -0.51294466 0.00000000 133 0.21954348 0.00000000 1.00000000 134$ D-TYPE FUNCTIONS 135 1 1 0 136 1.00000000 1.00000000 137a 8 138$ OXYGEN (7s,4p) -> [3s,2p] 139$ OXYGEN (1d) 140$ S-TYPE FUNCTIONS 141 7 3 0 142 2266.17677900 -0.00534318 0.00000000 0.00000000 143 340.87010190 -0.03989004 0.00000000 0.00000000 144 77.36313517 -0.17853912 0.00000000 0.00000000 145 21.47964494 -0.46427685 0.00000000 0.00000000 146 6.65894331 -0.44309745 0.00000000 0.00000000 147 0.80975976 0.00000000 1.00000000 0.00000000 148 0.25530772 0.00000000 0.00000000 1.00000000 149$ P-TYPE FUNCTIONS 150 4 2 0 151 17.72150432 0.04339457 0.00000000 152 3.86355054 0.23094121 0.00000000 153 1.04809209 0.51375311 0.00000000 154 0.27641544 0.00000000 1.00000000 155$ D-TYPE FUNCTIONS 156 1 1 0 157 1.20000000 1.00000000 158a 9 159$ FLUORINE (7s,4p) -> [3s,2p] 160$ FLUORINE (1d) 161$ S-TYPE FUNCTIONS 162 7 3 0 163 2894.83259900 -0.00534083 0.00000000 0.00000000 164 435.41939120 -0.03990426 0.00000000 0.00000000 165 98.84332887 -0.17912768 0.00000000 0.00000000 166 27.48519800 -0.46758091 0.00000000 0.00000000 167 8.54054982 -0.44653131 0.00000000 0.00000000 168 1.06545780 0.00000000 1.00000000 0.00000000 169 0.33247347 0.00000000 0.00000000 1.00000000 170$ P-TYPE FUNCTIONS 171 4 2 0 172 22.69663392 -0.04521287 0.00000000 173 4.98723393 -0.23754317 0.00000000 174 1.34916140 -0.51287354 0.00000000 175 0.34829882 0.00000000 1.00000000 176$ D-TYPE FUNCTIONS 177 1 1 0 178 1.40000000 1.00000000 179a 10 180$ NEON (7s,4p) -> [3s,2p] 181$ NEON (1d) 182$ S-TYPE FUNCTIONS 183 7 3 0 184 3598.97366300 -0.00532593 0.00000000 0.00000000 185 541.32073110 -0.03981742 0.00000000 0.00000000 186 122.90450060 -0.17914358 0.00000000 0.00000000 187 34.21661702 -0.46893583 0.00000000 0.00000000 188 10.65058412 -0.44782538 0.00000000 0.00000000 189 1.35459540 0.00000000 1.00000000 0.00000000 190 0.41919363 0.00000000 0.00000000 1.00000000 191$ P-TYPE FUNCTIONS 192 4 2 0 193 28.42405379 -0.04603194 0.00000000 194 6.28225110 -0.23993183 0.00000000 195 1.69787151 -0.50871725 0.00000000 196 0.43300700 0.00000000 1.00000000 197$ D-TYPE FUNCTIONS 198 1 1 0 199 1.88800000 1.00000000 200a 11 201$ SODIUM (10s,5p) -> [4s,1p] 202$ SODIUM (1p) 203$ S-TYPE FUNCTIONS 204 10 4 0 205 4098.20039100 -0.00585359 0.00000000 0.00000000 0.00000000 206 616.49374030 -0.04364716 0.00000000 0.00000000 0.00000000 207 139.96644000 -0.19431466 0.00000000 0.00000000 0.00000000 208 39.07344105 -0.48685066 0.00000000 0.00000000 0.00000000 209 11.92984721 -0.41881705 0.00000000 0.00000000 0.00000000 210 20.65996603 0.00000000 0.08594969 0.00000000 0.00000000 211 1.98388610 0.00000000 -0.56359144 0.00000000 0.00000000 212 0.64836324 0.00000000 -0.51954009 0.00000000 0.00000000 213 0.05244397 0.00000000 0.00000000 1.00000000 0.00000000 214 0.02804816 0.00000000 0.00000000 0.00000000 1.00000000 215$ P-TYPE FUNCTIONS 216 6 2 0 217 75.40186202 0.01543536 0.00000000 218 17.27481898 0.09973829 0.00000000 219 5.18423474 0.31209594 0.00000000 220 1.66012120 0.49295675 0.00000000 221 0.51232529 0.32420398 0.00000000 222 0.52000000 0.00000000 1.00000000 223a 12 224$ MAGNESIUM (10s,5p) -> [4s,1p] 225$ MAGNESIUM (1p) 226$ S-TYPE FUNCTIONS 227 10 4 0 228 4953.83392000 -0.00577790 0.00000000 0.00000000 0.00000000 229 745.18044150 -0.04312476 0.00000000 0.00000000 0.00000000 230 169.21604970 -0.19268217 0.00000000 0.00000000 0.00000000 231 47.30067202 -0.48641439 0.00000000 0.00000000 0.00000000 232 14.46133697 -0.42550894 0.00000000 0.00000000 0.00000000 233 24.76817479 0.00000000 0.08795697 0.00000000 0.00000000 234 2.49409453 0.00000000 -0.55165058 0.00000000 0.00000000 235 0.87807585 0.00000000 -0.53443295 0.00000000 0.00000000 236 0.08721278 0.00000000 0.00000000 1.00000000 0.00000000 237 0.03359929 0.00000000 0.00000000 0.00000000 1.00000000 238$ P-TYPE FUNCTIONS 239 6 2 0 240 98.05301049 -0.01448056 0.00000000 241 22.58693228 -0.09549575 0.00000000 242 6.83915098 -0.30787673 0.00000000 243 2.23328438 -0.49936293 0.00000000 244 0.71606599 -0.31503476 0.00000000 245 0.18914796 0.00000000 1.00000000 246a 13 247$ ALUMINUM (10s,7p) -> [4s,3p] 248$ ALUMINUM (1d) 249$ S-TYPE FUNCTIONS 250 10 4 0 251 5887.57270300 0.00134833 0.00000000 0.00000000 0.00000000 252 885.61226000 0.01007158 0.00000000 0.00000000 0.00000000 253 201.13604900 0.04513245 0.00000000 0.00000000 0.00000000 254 56.28497467 0.11461268 0.00000000 0.00000000 0.00000000 255 17.22955124 0.10159609 0.00000000 0.00000000 0.00000000 256 29.34024992 0.00000000 0.06934745 0.00000000 0.00000000 257 3.04396304 0.00000000 -0.42528118 0.00000000 0.00000000 258 1.12855395 0.00000000 -0.41449832 0.00000000 0.00000000 259 0.14234175 0.00000000 0.00000000 1.00000000 0.00000000 260 0.05440019 0.00000000 0.00000000 0.00000000 1.00000000 261$ P-TYPE FUNCTIONS 262 7 3 0 263 145.11918810 0.00639634 0.00000000 0.00000000 264 33.71789483 0.04418936 0.00000000 0.00000000 265 10.36986308 0.15581576 0.00000000 0.00000000 266 3.51356160 0.28635287 0.00000000 0.00000000 267 1.19800503 0.22921423 0.00000000 0.00000000 268 0.26583006 0.00000000 1.00000000 0.00000000 269 0.71003362 0.00000000 0.00000000 1.00000000 270$ D-TYPE FUNCTIONS 271 1 1 0 272 0.30000000 1.00000000 273a 14 274$ SILICON (10s,7p) -> [4s,3p] 275$ SILICON (1d) 276$ S-TYPE FUNCTIONS 277 10 4 0 278 6903.71186900 0.00133740 0.00000000 0.00000000 0.00000000 279 1038.43464200 0.00999665 0.00000000 0.00000000 0.00000000 280 235.87581480 0.04491017 0.00000000 0.00000000 0.00000000 281 66.06938517 0.11463639 0.00000000 0.00000000 0.00000000 282 20.24794576 0.10280064 0.00000000 0.00000000 0.00000000 283 34.35348173 0.00000000 0.07083729 0.00000000 0.00000000 284 3.63707882 0.00000000 -0.43028836 0.00000000 0.00000000 285 1.40020486 0.00000000 -0.41382775 0.00000000 0.00000000 286 0.20484415 0.00000000 0.00000000 1.00000000 0.00000000 287 0.07799410 0.00000000 0.00000000 0.00000000 1.00000000 288$ P-TYPE FUNCTIONS 289 7 3 0 290 179.83907370 0.00619167 0.00000000 0.00000000 291 41.90725885 0.04339943 0.00000000 0.00000000 292 12.95529437 0.15632019 0.00000000 0.00000000 293 4.43832674 0.29419997 0.00000000 0.00000000 294 1.54622479 0.23536824 0.00000000 0.00000000 295 0.35607612 0.00000000 1.00000000 0.00000000 296 0.10008514 0.00000000 0.00000000 1.00000000 297$ D-TYPE FUNCTIONS 298 1 1 0 299 0.35000000 1.00000000 300a 15 301$ PHOSPHORUS (10s,7p) -> [4s,3p] 302$ PHOSPHORUS (1d) 303$ S-TYPE FUNCTIONS 304 10 4 0 305 8002.47951100 0.00575035 0.00000000 0.00000000 0.00000000 306 1203.68135900 0.04300763 0.00000000 0.00000000 0.00000000 307 273.44227030 0.19363986 0.00000000 0.00000000 0.00000000 308 76.65554152 0.49651693 0.00000000 0.00000000 0.00000000 309 23.51692744 0.44983262 0.00000000 0.00000000 0.00000000 310 39.79168344 0.00000000 0.09518813 0.00000000 0.00000000 311 4.27703433 0.00000000 -0.57649840 0.00000000 0.00000000 312 1.69402569 0.00000000 -0.54239584 0.00000000 0.00000000 313 0.27567675 0.00000000 0.00000000 1.00000000 0.00000000 314 0.10495590 0.00000000 0.00000000 0.00000000 1.00000000 315$ P-TYPE FUNCTIONS 316 7 3 0 317 219.50755820 0.00921006 0.00000000 0.00000000 318 51.27415503 0.06540977 0.00000000 0.00000000 319 15.92159589 0.24033730 0.00000000 0.00000000 320 5.50699135 0.46318322 0.00000000 0.00000000 321 1.95377194 0.37392563 0.00000000 0.00000000 322 0.47803398 0.00000000 1.00000000 0.00000000 323 0.13657953 0.00000000 0.00000000 1.00000000 324$ D-TYPE FUNCTIONS 325 1 1 0 326 0.45000000 1.00000000 327a 16 328$ SULFUR (10s,7p) -> [4s,3p] 329$ SULFUR (1d) 330$ S-TYPE FUNCTIONS 331 10 4 0 332 9184.93030100 -0.00222944 0.00000000 0.00000000 0.00000000 333 1381.51055000 -0.01668303 0.00000000 0.00000000 0.00000000 334 313.87147580 -0.07526244 0.00000000 0.00000000 0.00000000 335 88.05387062 -0.19376827 0.00000000 0.00000000 0.00000000 336 27.03991491 -0.17718021 0.00000000 0.00000000 0.00000000 337 45.64873130 0.00000000 -0.10736063 0.00000000 0.00000000 338 4.96645223 0.00000000 0.65066293 0.00000000 0.00000000 339 2.01162420 0.00000000 0.59712155 0.00000000 0.00000000 340 0.35661077 0.00000000 0.00000000 1.00000000 0.00000000 341 0.13507221 0.00000000 0.00000000 0.00000000 1.00000000 342$ P-TYPE FUNCTIONS 343 7 3 0 344 261.98233440 -0.00927299 0.00000000 0.00000000 345 61.30689474 -0.06654767 0.00000000 0.00000000 346 19.10372989 -0.24828596 0.00000000 0.00000000 347 6.65677204 -0.48703847 0.00000000 0.00000000 348 2.39596352 -0.39337850 0.00000000 0.00000000 349 0.61776162 0.00000000 1.00000000 0.00000000 350 0.16993377 0.00000000 0.00000000 1.00000000 351$ D-TYPE FUNCTIONS 352 1 1 0 353 0.55000000 1.00000000 354a 17 355$ CHLORINE (10s,7p) -> [4s,3p] 356$ CHLORINE (1d) 357$ S-TYPE FUNCTIONS 358 10 4 0 359 10449.82757 0.00197084 0.00000000 0.00000000 0.00000000 360 1571.73652200 0.01475473 0.00000000 0.00000000 0.00000000 361 357.12065520 0.06667911 0.00000000 0.00000000 0.00000000 362 100.25185940 0.17228924 0.00000000 0.00000000 0.00000000 363 30.81272755 0.15883786 0.00000000 0.00000000 0.00000000 364 51.92378943 0.00000000 -0.10009299 0.00000000 0.00000000 365 5.70457610 0.00000000 0.60841753 0.00000000 0.00000000 366 2.35083768 0.00000000 0.54352153 0.00000000 0.00000000 367 0.44605125 0.00000000 0.00000000 1.00000000 0.00000000 368 0.16848856 0.00000000 0.00000000 0.00000000 1.00000000 369$ P-TYPE FUNCTIONS 370 7 3 0 371 307.66790570 -0.00878015 0.00000000 0.00000000 372 72.10201551 -0.06356336 0.00000000 0.00000000 373 22.53268026 -0.24016428 0.00000000 0.00000000 374 7.89917654 -0.47798867 0.00000000 0.00000000 375 2.87672683 -0.38515850 0.00000000 0.00000000 376 0.77459364 0.00000000 1.00000000 0.00000000 377 0.21037700 0.00000000 0.00000000 1.00000000 378$ D-TYPE FUNCTIONS 379 1 1 0 380 0.65000000 1.00000000 381a 18 382$ ARGON (10s,7p) -> [4s,3p] 383$ ARGON (1d) 384$ S-TYPE FUNCTIONS 385 10 4 0 386 11797.11977 0.00202145 0.00000000 0.00000000 0.00000000 387 1774.35227500 0.01513985 0.00000000 0.00000000 0.00000000 388 403.18875730 0.06852540 0.00000000 0.00000000 0.00000000 389 113.24934000 0.17762929 0.00000000 0.00000000 0.00000000 390 34.83529819 0.16496495 0.00000000 0.00000000 0.00000000 391 58.61477504 0.00000000 -0.10343394 0.00000000 0.00000000 392 6.49220451 0.00000000 0.63133366 0.00000000 0.00000000 393 2.71170144 0.00000000 0.54887572 0.00000000 0.00000000 394 0.54412975 0.00000000 0.00000000 1.00000000 0.00000000 395 0.20517411 0.00000000 0.00000000 0.00000000 1.00000000 396$ P-TYPE FUNCTIONS 397 7 3 0 398 356.28707260 -0.00873218 0.00000000 0.00000000 399 83.59313287 -0.06368032 0.00000000 0.00000000 400 26.18670403 -0.24311907 0.00000000 0.00000000 401 9.22572759 -0.48956070 0.00000000 0.00000000 402 3.39227549 -0.39229190 0.00000000 0.00000000 403 0.94740534 0.00000000 1.00000000 0.00000000 404 0.25659135 0.00000000 0.00000000 1.00000000 405$ D-TYPE FUNCTIONS 406 1 1 0 407 0.96900000 1.00000000 408a 19 409$ POTASSIUM (14s,8p) -> [5s,2p] 410$ POTASSIUM (1p) 411$ S-TYPE FUNCTIONS 412 14 5 0 413 31478.74676 0.00398387 0.00000000 0.00000000 0.00000000 0.00000000 414 4726.88760700 0.03050176 0.00000000 0.00000000 0.00000000 0.00000000 415 1075.43453500 0.15073753 0.00000000 0.00000000 0.00000000 0.00000000 416 303.39811020 0.51912940 0.00000000 0.00000000 0.00000000 0.00000000 417 98.32711283 1.03669570 0.00000000 0.00000000 0.00000000 0.00000000 418 33.63622218 0.76398963 0.00000000 0.00000000 0.00000000 0.00000000 419 65.63920996 0.00000000 -0.28242617 0.00000000 0.00000000 0.00000000 420 7.31625922 0.00000000 1.69149359 0.00000000 0.00000000 0.00000000 421 2.89025801 0.00000000 1.29653320 0.00000000 0.00000000 0.00000000 422 4.54597490 0.00000000 0.00000000 -0.00763436 0.00000000 0.00000000 423 0.70404124 0.00000000 0.00000000 0.02563572 0.00000000 0.00000000 424 0.28266889 0.00000000 0.00000000 0.01660686 0.00000000 0.00000000 425 0.02905816 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 426 0.01211164 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 427$ P-TYPE FUNCTIONS 428 9 3 0 429 361.22492150 0.02090648 0.00000000 0.00000000 430 84.67022217 0.15043642 0.00000000 0.00000000 431 26.46908824 0.55440061 0.00000000 0.00000000 432 9.26580776 1.04090100 0.00000000 0.00000000 433 3.34233883 0.67825341 0.00000000 0.00000000 434 1.51008761 0.00000000 0.75248191 0.00000000 435 0.56568375 0.00000000 1.37085850 0.00000000 436 0.20817009 0.00000000 0.66047633 0.00000000 437 0.41737000 0.00000000 0.00000000 1.00000000 438a 20 439$ CALCIUM (14s,8p) -> [5s,2p] 440$ CALCIUM (1p) 441$ S-TYPE FUNCTIONS 442 14 5 0 443 35138.71393 0.00394825 0.00000000 0.00000000 0.00000000 0.00000000 444 5276.41113500 0.03023424 0.00000000 0.00000000 0.00000000 0.00000000 445 1200.46925900 0.14952020 0.00000000 0.00000000 0.00000000 0.00000000 446 338.71810540 0.51597346 0.00000000 0.00000000 0.00000000 0.00000000 447 109.85385920 1.03395103 0.00000000 0.00000000 0.00000000 0.00000000 448 37.60888030 0.76937934 0.00000000 0.00000000 0.00000000 0.00000000 449 73.10797755 0.00000000 -0.28268525 0.00000000 0.00000000 0.00000000 450 8.24077057 0.00000000 1.67960921 0.00000000 0.00000000 0.00000000 451 3.29598130 0.00000000 1.28037660 0.00000000 0.00000000 0.00000000 452 5.23418009 0.00000000 0.00000000 -0.00768686 0.00000000 0.00000000 453 0.84187221 0.00000000 0.00000000 0.02538238 0.00000000 0.00000000 454 0.36510294 0.00000000 0.00000000 0.01651217 0.00000000 0.00000000 455 0.05122240 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 456 0.01982511 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 457$ P-TYPE FUNCTIONS 458 9 3 0 459 413.11313890 0.02032714 0.00000000 0.00000000 460 96.93578622 0.14730276 0.00000000 0.00000000 461 30.37215466 0.54887167 0.00000000 0.00000000 462 10.68477683 1.04406598 0.00000000 0.00000000 463 3.88212584 0.68653491 0.00000000 0.00000000 464 1.79930163 0.00000000 0.75410247 0.00000000 465 0.69189057 0.00000000 1.34092966 0.00000000 466 0.26364024 0.00000000 0.56391989 0.00000000 467 0.74979000 0.00000000 0.00000000 1.00000000 468a 21 469$ SCANDIUM (14s,8p,5d) -> [5s,2p,2d] 470$ SCANDIUM (1p) 471$ S-TYPE FUNCTIONS 472 14 5 0 473 38956.08180 0.00392932 0.00000000 0.00000000 0.00000000 0.00000000 474 5849.57336400 0.03009322 0.00000000 0.00000000 0.00000000 0.00000000 475 1330.88131500 0.14890371 0.00000000 0.00000000 0.00000000 0.00000000 476 375.55534170 0.51464283 0.00000000 0.00000000 0.00000000 0.00000000 477 121.87261370 1.03377081 0.00000000 0.00000000 0.00000000 0.00000000 478 41.76024373 0.77436852 0.00000000 0.00000000 0.00000000 0.00000000 479 81.06063395 0.00000000 -0.28318552 0.00000000 0.00000000 0.00000000 480 9.20598240 0.00000000 1.67708070 0.00000000 0.00000000 0.00000000 481 3.70632157 0.00000000 1.25947337 0.00000000 0.00000000 0.00000000 482 5.98889100 0.00000000 0.00000000 -0.00778214 0.00000000 0.00000000 483 0.97363432 0.00000000 0.00000000 0.02549969 0.00000000 0.00000000 484 0.42041019 0.00000000 0.00000000 0.01619156 0.00000000 0.00000000 485 0.05944055 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 486 0.02289781 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 487$ P-TYPE FUNCTIONS 488 9 3 0 489 466.31481260 0.01998430 0.00000000 0.00000000 490 109.51217100 0.14561043 0.00000000 0.00000000 491 34.37592183 0.54687466 0.00000000 0.00000000 492 12.14209696 1.04790060 0.00000000 0.00000000 493 4.43367677 0.68894890 0.00000000 0.00000000 494 2.09712919 0.00000000 0.75619215 0.00000000 495 0.80977607 0.00000000 1.31782122 0.00000000 496 0.30834047 0.00000000 0.54312268 0.00000000 497 0.89748000 0.00000000 0.00000000 1.00000000 498$ D-TYPE FUNCTIONS 499 5 2 0 500 19.24033493 0.02703908 0.00000000 501 5.11789959 0.13803685 0.00000000 502 1.65542788 0.34869086 0.00000000 503 0.54016356 0.48594186 0.00000000 504 0.16211215 0.00000000 1.00000000 505a 22 506$ TITANIUM (14s,8p,5d) -> [5s,2p,2d] 507$ TITANIUM (1p) 508$ S-TYPE FUNCTIONS 509 14 5 0 510 42961.51218 0.00391276 0.00000000 0.00000000 0.00000000 0.00000000 511 6450.97591700 0.02996982 0.00000000 0.00000000 0.00000000 0.00000000 512 1467.72109200 0.14836353 0.00000000 0.00000000 0.00000000 0.00000000 513 414.20997350 0.51347285 0.00000000 0.00000000 0.00000000 0.00000000 514 134.48715840 1.03353655 0.00000000 0.00000000 0.00000000 0.00000000 515 46.12220980 0.77854234 0.00000000 0.00000000 0.00000000 0.00000000 516 89.44776254 0.00000000 -0.28385401 0.00000000 0.00000000 0.00000000 517 10.22334606 0.00000000 1.67727853 0.00000000 0.00000000 0.00000000 518 4.13537743 0.00000000 1.24119285 0.00000000 0.00000000 0.00000000 519 6.78961815 0.00000000 0.00000000 -0.00784000 0.00000000 0.00000000 520 1.11067307 0.00000000 0.00000000 0.02549549 0.00000000 0.00000000 521 0.47565976 0.00000000 0.00000000 0.01606117 0.00000000 0.00000000 522 0.06598696 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 523 0.02521034 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 524$ P-TYPE FUNCTIONS 525 9 3 0 526 522.03684780 0.01975418 0.00000000 0.00000000 527 122.68649490 0.14460678 0.00000000 0.00000000 528 38.57290361 0.54669004 0.00000000 0.00000000 529 13.67216932 1.05316475 0.00000000 0.00000000 530 5.01185294 0.69111213 0.00000000 0.00000000 531 2.41319283 0.00000000 0.75803437 0.00000000 532 0.93252270 0.00000000 1.30362414 0.00000000 533 0.35429058 0.00000000 0.53638653 0.00000000 534 0.10156100 0.00000000 0.00000000 1.00000000 535$ D-TYPE FUNCTIONS 536 5 2 0 537 23.46512596 0.02653638 0.00000000 538 6.33325938 0.13796454 0.00000000 539 2.07664900 0.35312644 0.00000000 540 0.69027362 0.48647124 0.00000000 541 0.21088739 0.00000000 0.33026314 542a 23 543$ VANADIUM (14s,8p,5d) -> [5s,2p,2d] 544$ VANADIUM (1p) 545$ S-TYPE FUNCTIONS 546 14 5 0 547 47160.37606 0.00144987 0.00000000 0.00000000 0.00000000 0.00000000 548 7081.41108700 0.01110644 0.00000000 0.00000000 0.00000000 0.00000000 549 1611.16212200 0.05500542 0.00000000 0.00000000 0.00000000 0.00000000 550 454.72940550 0.19060253 0.00000000 0.00000000 0.00000000 0.00000000 551 147.71321210 0.38435023 0.00000000 0.00000000 0.00000000 0.00000000 552 50.69953895 0.29095547 0.00000000 0.00000000 0.00000000 0.00000000 553 98.26249267 0.00000000 -0.10942338 0.00000000 0.00000000 0.00000000 554 11.29429310 0.00000000 0.64539490 0.00000000 0.00000000 0.00000000 555 4.58533601 0.00000000 0.47117881 0.00000000 0.00000000 0.00000000 556 7.63596896 0.00000000 0.00000000 -0.22454949 0.00000000 0.00000000 557 1.25398367 0.00000000 0.00000000 0.72594853 0.00000000 0.00000000 558 0.53271935 0.00000000 0.00000000 0.45560583 0.00000000 0.00000000 559 0.07224624 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 560 0.02735809 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 561$ P-TYPE FUNCTIONS 562 9 3 0 563 580.55044990 0.00973151 0.00000000 0.00000000 564 136.52341130 0.07153124 0.00000000 0.00000000 565 42.98395882 0.27197688 0.00000000 0.00000000 566 15.28279876 0.52618989 0.00000000 0.00000000 567 5.62024952 0.34452533 0.00000000 0.00000000 568 2.74853864 0.00000000 0.34040396 0.00000000 569 1.06185501 0.00000000 0.57983996 0.00000000 570 0.40235519 0.00000000 0.23911643 0.00000000 571 0.11124800 0.00000000 0.00000000 1.00000000 572$ D-TYPE FUNCTIONS 573 5 2 0 574 27.35843402 0.02664193 0.00000000 575 7.45406042 0.13995312 0.00000000 576 2.46339178 0.35751067 0.00000000 577 0.82480925 0.48488354 0.00000000 578 0.25257905 0.00000000 0.32332845 579a 24 580$ CHROMIUM (14s,8p,5d) -> [5s,2p,2d] 581$ CHROMIUM (1p) 582$ S-TYPE FUNCTIONS 583 14 5 0 584 51528.08635 0.00144058 0.00000000 0.00000000 0.00000000 0.00000000 585 7737.21034900 0.01103620 0.00000000 0.00000000 0.00000000 0.00000000 586 1760.37484700 0.05467665 0.00000000 0.00000000 0.00000000 0.00000000 587 496.87706540 0.18965038 0.00000000 0.00000000 0.00000000 0.00000000 588 161.46520600 0.38295413 0.00000000 0.00000000 0.00000000 0.00000000 589 55.46635227 0.29090051 0.00000000 0.00000000 0.00000000 0.00000000 590 107.54733000 0.00000000 -0.10932281 0.00000000 0.00000000 0.00000000 591 12.40867190 0.00000000 0.64472599 0.00000000 0.00000000 0.00000000 592 5.04236288 0.00000000 0.46262713 0.00000000 0.00000000 0.00000000 593 8.54616402 0.00000000 0.00000000 -0.22711013 0.00000000 0.00000000 594 1.39004412 0.00000000 0.00000000 0.73301528 0.00000000 0.00000000 595 0.56066603 0.00000000 0.00000000 0.44225565 0.00000000 0.00000000 596 0.07148371 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 597 0.02825069 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 598$ P-TYPE FUNCTIONS 599 9 3 0 600 640.48536100 0.00961267 0.00000000 0.00000000 601 150.69711190 0.07088983 0.00000000 0.00000000 602 47.50375530 0.27065259 0.00000000 0.00000000 603 16.93412017 0.52437343 0.00000000 0.00000000 604 6.24096806 0.34107995 0.00000000 0.00000000 605 3.08854632 0.00000000 0.33973987 0.00000000 606 1.17910478 0.00000000 0.57272063 0.00000000 607 0.43369774 0.00000000 0.24582728 0.00000000 608 0.12067500 0.00000000 0.00000000 1.00000000 609$ D-TYPE FUNCTIONS 610 5 2 0 611 27.55947943 0.03061249 0.00000000 612 7.46870203 0.15593271 0.00000000 613 2.43459036 0.36984421 0.00000000 614 0.78244755 0.47071118 0.00000000 615 0.21995774 0.00000000 0.33941650 616a 25 617$ MANGANESE (14s,8p,5d) -> [5s,2p,2d] 618$ MANGANESE (1p) 619$ S-TYPE FUNCTIONS 620 14 5 0 621 56137.00904 0.00143213 0.00000000 0.00000000 0.00000000 0.00000000 622 8429.20639400 0.01097251 0.00000000 0.00000000 0.00000000 0.00000000 623 1917.82772300 0.05438247 0.00000000 0.00000000 0.00000000 0.00000000 624 541.36230200 0.18884335 0.00000000 0.00000000 0.00000000 0.00000000 625 176.00069140 0.38198025 0.00000000 0.00000000 0.00000000 0.00000000 626 60.50047701 0.29156773 0.00000000 0.00000000 0.00000000 0.00000000 627 117.17282880 0.00000000 -0.10933661 0.00000000 0.00000000 0.00000000 628 13.59697337 0.00000000 0.64305039 0.00000000 0.00000000 0.00000000 629 5.54839963 0.00000000 0.45848971 0.00000000 0.00000000 0.00000000 630 9.46628535 0.00000000 0.00000000 -0.22538977 0.00000000 0.00000000 631 1.55950061 0.00000000 0.00000000 0.72307759 0.00000000 0.00000000 632 0.65230206 0.00000000 0.00000000 0.45300722 0.00000000 0.00000000 633 0.08400373 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 634 0.03125610 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 635$ P-TYPE FUNCTIONS 636 9 3 0 637 706.00497540 0.00950555 0.00000000 0.00000000 638 166.19728820 0.07035627 0.00000000 0.00000000 639 52.45206191 0.27005557 0.00000000 0.00000000 640 18.74693286 0.52574345 0.00000000 0.00000000 641 6.92829916 0.34254033 0.00000000 0.00000000 642 3.47722049 0.00000000 0.33994074 0.00000000 643 1.34069065 0.00000000 0.57203836 0.00000000 644 0.50498803 0.00000000 0.23847606 0.00000000 645 0.12765000 0.00000000 0.00000000 1.00000000 646$ D-TYPE FUNCTIONS 647 5 2 0 648 35.42326493 0.02698530 0.00000000 649 9.78142215 0.14383459 0.00000000 650 3.26734888 0.36418958 0.00000000 651 1.10264722 0.48152671 0.00000000 652 0.33743206 0.00000000 0.31458754 653a 26 654$ IRON (14s,8p,5d) -> [5s,2p,2d] 655$ IRON (1p) 656$ S-TYPE FUNCTIONS 657 14 5 0 658 60923.64064 0.00143023 0.00000000 0.00000000 0.00000000 0.00000000 659 9147.88939800 0.01095879 0.00000000 0.00000000 0.00000000 0.00000000 660 2081.35059300 0.05433255 0.00000000 0.00000000 0.00000000 0.00000000 661 587.55977070 0.18884995 0.00000000 0.00000000 0.00000000 0.00000000 662 191.09043990 0.38253070 0.00000000 0.00000000 0.00000000 0.00000000 663 65.73273011 0.29308336 0.00000000 0.00000000 0.00000000 0.00000000 664 127.25891930 0.00000000 -0.10964565 0.00000000 0.00000000 0.00000000 665 14.83091301 0.00000000 0.64387631 0.00000000 0.00000000 0.00000000 666 6.06533074 0.00000000 0.45472347 0.00000000 0.00000000 0.00000000 667 10.44994371 0.00000000 0.00000000 -0.22539640 0.00000000 0.00000000 668 1.72452280 0.00000000 0.00000000 0.72164398 0.00000000 0.00000000 669 0.71772177 0.00000000 0.00000000 0.44985493 0.00000000 0.00000000 670 0.09144983 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 671 0.03370669 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 672$ P-TYPE FUNCTIONS 673 9 3 0 674 773.43750990 0.00943257 0.00000000 0.00000000 675 182.15149710 0.07002962 0.00000000 0.00000000 676 57.54727276 0.26993652 0.00000000 0.00000000 677 20.61498894 0.52700011 0.00000000 0.00000000 678 7.63485579 0.34284148 0.00000000 0.00000000 679 3.87193280 0.00000000 0.33974403 0.00000000 680 1.49247241 0.00000000 0.56842594 0.00000000 681 0.56061285 0.00000000 0.23649366 0.00000000 682 0.13491500 0.00000000 0.00000000 1.00000000 683$ D-TYPE FUNCTIONS 684 5 2 0 685 38.96813342 0.02787966 0.00000000 686 10.80006708 0.14858320 0.00000000 687 3.61364580 0.36905479 0.00000000 688 1.21299679 0.47745101 0.00000000 689 0.36524393 0.00000000 0.31418142 690a 27 691$ COBALT (14s,8p,5d) -> [5s,2p,2d] 692$ COBALT (1p) 693$ S-TYPE FUNCTIONS 694 14 5 0 695 65902.20826 0.00142846 0.00000000 0.00000000 0.00000000 0.00000000 696 9895.38960300 0.01094607 0.00000000 0.00000000 0.00000000 0.00000000 697 2251.43057900 0.05428595 0.00000000 0.00000000 0.00000000 0.00000000 698 635.61097080 0.18885179 0.00000000 0.00000000 0.00000000 0.00000000 699 206.78820680 0.38301635 0.00000000 0.00000000 0.00000000 0.00000000 700 71.17924297 0.29443551 0.00000000 0.00000000 0.00000000 0.00000000 701 137.77268040 0.00000000 -0.10990222 0.00000000 0.00000000 0.00000000 702 16.11807924 0.00000000 0.64455537 0.00000000 0.00000000 0.00000000 703 6.60303277 0.00000000 0.45116788 0.00000000 0.00000000 0.00000000 704 11.47991579 0.00000000 0.00000000 -0.22593847 0.00000000 0.00000000 705 1.89564263 0.00000000 0.00000000 0.72231409 0.00000000 0.00000000 706 0.78466232 0.00000000 0.00000000 0.44903812 0.00000000 0.00000000 707 0.09842577 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 708 0.03594574 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 709$ P-TYPE FUNCTIONS 710 9 3 0 711 843.64358580 0.00938661 0.00000000 0.00000000 712 198.76386990 0.06988021 0.00000000 0.00000000 713 62.85496310 0.27037070 0.00000000 0.00000000 714 22.56284228 0.52904787 0.00000000 0.00000000 715 8.37132091 0.34357030 0.00000000 0.00000000 716 4.28587198 0.00000000 0.34027999 0.00000000 717 1.65080418 0.00000000 0.56693392 0.00000000 718 0.61834231 0.00000000 0.23617980 0.00000000 719 0.14130800 0.00000000 0.00000000 1.00000000 720$ D-TYPE FUNCTIONS 721 5 2 0 722 42.92786761 0.02848779 0.00000000 723 11.94253305 0.15206951 0.00000000 724 4.00464957 0.37310914 0.00000000 725 1.34131938 0.47549838 0.00000000 726 0.40015010 0.00000000 0.31346831 727a 28 728$ NICKEL (14s,8p,5d) -> [5s,2p,2d] 729$ NICKEL (1p) 730$ S-TYPE FUNCTIONS 731 14 5 0 732 71074.80321 0.00142604 0.00000000 0.00000000 0.00000000 0.00000000 733 10672.02094 0.01092824 0.00000000 0.00000000 0.00000000 0.00000000 734 2428.13890100 0.05421263 0.00000000 0.00000000 0.00000000 0.00000000 735 685.53595150 0.18874769 0.00000000 0.00000000 0.00000000 0.00000000 736 223.10072860 0.38324617 0.00000000 0.00000000 0.00000000 0.00000000 737 76.84201404 0.29550637 0.00000000 0.00000000 0.00000000 0.00000000 738 148.71122020 0.00000000 -0.11014443 0.00000000 0.00000000 0.00000000 739 17.45915499 0.00000000 0.64521427 0.00000000 0.00000000 0.00000000 740 7.16252807 0.00000000 0.44797838 0.00000000 0.00000000 0.00000000 741 12.55613713 0.00000000 0.00000000 -0.22645403 0.00000000 0.00000000 742 2.07357405 0.00000000 0.00000000 0.72320959 0.00000000 0.00000000 743 0.85382641 0.00000000 0.00000000 0.44868026 0.00000000 0.00000000 744 0.10536766 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 745 0.03813409 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 746$ P-TYPE FUNCTIONS 747 9 3 0 748 916.73608660 0.00934396 0.00000000 0.00000000 749 216.06139910 0.06973737 0.00000000 0.00000000 750 68.38391482 0.27073495 0.00000000 0.00000000 751 24.59384395 0.53078302 0.00000000 0.00000000 752 9.13929602 0.34410229 0.00000000 0.00000000 753 4.71933717 0.00000000 0.34076082 0.00000000 754 1.81618492 0.00000000 0.56580170 0.00000000 755 0.67840751 0.00000000 0.23616717 0.00000000 756 0.14658800 0.00000000 0.00000000 1.00000000 757$ D-TYPE FUNCTIONS 758 5 2 0 759 47.09383211 0.02898232 0.00000000 760 13.14646397 0.15494996 0.00000000 761 4.41705489 0.37633115 0.00000000 762 1.47715651 0.47365096 0.00000000 763 0.43735922 0.00000000 0.31247838 764a 29 765$ COPPER (14s,8p,5d) -> [5s,2p,2d] 766$ COPPER (1p) 767$ S-TYPE FUNCTIONS 768 14 5 0 769 76381.34806 0.00143361 0.00000000 0.00000000 0.00000000 0.00000000 770 11468.77750 0.01098675 0.00000000 0.00000000 0.00000000 0.00000000 771 2609.42464900 0.05451365 0.00000000 0.00000000 0.00000000 0.00000000 772 736.75033100 0.18990128 0.00000000 0.00000000 0.00000000 0.00000000 773 239.82419960 0.38581959 0.00000000 0.00000000 0.00000000 0.00000000 774 82.65682925 0.29790607 0.00000000 0.00000000 0.00000000 0.00000000 775 160.13544200 0.00000000 -0.11146779 0.00000000 0.00000000 0.00000000 776 18.83417770 0.00000000 0.65349301 0.00000000 0.00000000 0.00000000 777 7.71765957 0.00000000 0.44770534 0.00000000 0.00000000 0.00000000 778 13.71084672 0.00000000 0.00000000 -0.22870911 0.00000000 0.00000000 779 2.23498957 0.00000000 0.00000000 0.73464423 0.00000000 0.00000000 780 0.87818360 0.00000000 0.00000000 0.43273071 0.00000000 0.00000000 781 0.08718746 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 782 0.03296911 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 783$ P-TYPE FUNCTIONS 784 9 3 0 785 991.24075780 0.00938785 0.00000000 0.00000000 786 233.69376120 0.07020828 0.00000000 0.00000000 787 74.02093093 0.27323522 0.00000000 0.00000000 788 26.66496745 0.53580793 0.00000000 0.00000000 789 9.91920875 0.34575795 0.00000000 0.00000000 790 5.15195539 0.00000000 0.34229108 0.00000000 791 1.96382058 0.00000000 0.56456592 0.00000000 792 0.71560097 0.00000000 0.24078584 0.00000000 793 0.15506500 0.00000000 0.00000000 1.00000000 794$ D-TYPE FUNCTIONS 795 5 2 0 796 47.33504959 0.03237555 0.00000000 797 13.16166608 0.16810219 0.00000000 798 4.36937772 0.38477708 0.00000000 799 1.41329251 0.46147880 0.00000000 800 0.38878001 0.00000000 0.32388873 801a 30 802$ ZINC (13s,8p,5d) -> [5s,2p,2d] 803$ ZINC (1p) 804$ S-TYPE FUNCTIONS 805 14 5 0 806 82000.71163 0.00142108 0.00000000 0.00000000 0.00000000 0.00000000 807 12312.47178 0.01089150 0.00000000 0.00000000 0.00000000 0.00000000 808 2801.39441900 0.05405719 0.00000000 0.00000000 0.00000000 0.00000000 809 790.99424300 0.18847464 0.00000000 0.00000000 0.00000000 0.00000000 810 257.56551080 0.38346549 0.00000000 0.00000000 0.00000000 0.00000000 811 88.81493340 0.29723794 0.00000000 0.00000000 0.00000000 0.00000000 812 171.86353720 0.00000000 -0.11051850 0.00000000 0.00000000 0.00000000 813 20.30253478 0.00000000 0.64607717 0.00000000 0.00000000 0.00000000 814 8.34641231 0.00000000 0.44220117 0.00000000 0.00000000 0.00000000 815 14.84753694 0.00000000 0.00000000 -0.22705309 0.00000000 0.00000000 816 2.44950295 0.00000000 0.00000000 0.72433218 0.00000000 0.00000000 817 0.99845822 0.00000000 0.00000000 0.44836496 0.00000000 0.00000000 818 0.11891308 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 819 0.04229743 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 820$ P-TYPE FUNCTIONS 821 9 3 0 822 1071.51853700 0.00927678 0.00000000 0.00000000 823 252.69712150 0.06954115 0.00000000 0.00000000 824 80.10082913 0.27156773 0.00000000 0.00000000 825 28.90339317 0.53401356 0.00000000 0.00000000 826 10.76889988 0.34501323 0.00000000 0.00000000 827 5.64462125 0.00000000 0.34129600 0.00000000 828 2.16782913 0.00000000 0.56390522 0.00000000 829 0.80540898 0.00000000 0.23676110 0.00000000 830 0.16245500 0.00000000 0.00000000 1.00000000 831$ D-TYPE FUNCTIONS 832 5 2 0 833 56.08893919 0.02958887 0.00000000 834 15.75190892 0.15872571 0.00000000 835 5.31158124 0.37976229 0.00000000 836 1.77379049 0.46898959 0.00000000 837 0.51975584 0.00000000 0.30907149 838a 31 839$ GALLIUM (14s,10p,5d) -> [5s,4p,2d] 840$ GALLIUM (1d) 841$ S-TYPE FUNCTIONS 842 14 5 0 843 87842.12630 0.00142716 0.00000000 0.00000000 0.00000000 0.00000000 844 13189.49640 0.01093889 0.00000000 0.00000000 0.00000000 0.00000000 845 3000.94821400 0.05430820 0.00000000 0.00000000 0.00000000 0.00000000 846 847.38425970 0.18951056 0.00000000 0.00000000 0.00000000 0.00000000 847 276.00980640 0.38615186 0.00000000 0.00000000 0.00000000 0.00000000 848 95.21667207 0.30051083 0.00000000 0.00000000 0.00000000 0.00000000 849 184.00703970 0.00000000 -0.11124462 0.00000000 0.00000000 0.00000000 850 21.82705143 0.00000000 0.64831323 0.00000000 0.00000000 0.00000000 851 9.00269638 0.00000000 0.44358384 0.00000000 0.00000000 0.00000000 852 16.03317694 0.00000000 0.00000000 -0.23014300 0.00000000 0.00000000 853 2.67077249 0.00000000 0.00000000 0.72946862 0.00000000 0.00000000 854 1.12528342 0.00000000 0.00000000 0.46214977 0.00000000 0.00000000 855 0.15967609 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 856 0.05764304 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 857$ P-TYPE FUNCTIONS 858 10 4 0 859 1167.26658400 0.00909740 0.00000000 0.00000000 0.00000000 860 275.38062790 0.06845627 0.00000000 0.00000000 0.00000000 861 87.37507307 0.26922294 0.00000000 0.00000000 0.00000000 862 31.59725467 0.53507898 0.00000000 0.00000000 0.00000000 863 11.82412280 0.35279063 0.00000000 0.00000000 0.00000000 864 6.28818451 0.00000000 0.33938245 0.00000000 0.00000000 865 2.51998532 0.00000000 0.56871948 0.00000000 0.00000000 866 1.01697263 0.00000000 0.27717695 0.00000000 0.00000000 867 0.24748374 0.00000000 0.00000000 1.00000000 0.00000000 868 0.06668529 0.00000000 0.00000000 0.00000000 1.00000000 869$ D-TYPE FUNCTIONS 870 6 3 0 871 65.35423767 0.02737015 0.00000000 0.00000000 872 18.50465675 0.15099464 0.00000000 0.00000000 873 6.31796206 0.37485329 0.00000000 0.00000000 874 2.16413894 0.47510607 0.00000000 0.00000000 875 0.66693093 0.00000000 0.29843287 0.00000000 876 0.20700000 0.00000000 0.00000000 1.00000000 877a 32 878$ GERMANIUM (14s,10p,5d) -> [5s,4p,2d] 879$ GERMANIUM (1d) 880$ S-TYPE FUNCTIONS 881 14 5 0 882 93889.83664 0.00142340 0.00000000 0.00000000 0.00000000 0.00000000 883 14097.49753 0.01091080 0.00000000 0.00000000 0.00000000 0.00000000 884 3207.54773100 0.05418371 0.00000000 0.00000000 0.00000000 0.00000000 885 905.76727270 0.18922820 0.00000000 0.00000000 0.00000000 0.00000000 886 295.11014690 0.38612847 0.00000000 0.00000000 0.00000000 0.00000000 887 101.84713140 0.30164051 0.00000000 0.00000000 0.00000000 0.00000000 888 196.56719660 0.00000000 -0.11118771 0.00000000 0.00000000 0.00000000 889 23.40529252 0.00000000 0.64616007 0.00000000 0.00000000 0.00000000 890 9.68391167 0.00000000 0.44188905 0.00000000 0.00000000 0.00000000 891 17.26973654 0.00000000 0.00000000 -0.23027421 0.00000000 0.00000000 892 2.89646222 0.00000000 0.00000000 0.73017169 0.00000000 0.00000000 893 1.25536214 0.00000000 0.00000000 0.46197222 0.00000000 0.00000000 894 0.20213081 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 895 0.07386791 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 896$ P-TYPE FUNCTIONS 897 10 4 0 898 1259.20860000 0.00901155 0.00000000 0.00000000 0.00000000 899 297.15626380 0.06798684 0.00000000 0.00000000 0.00000000 900 94.35338752 0.26853856 0.00000000 0.00000000 0.00000000 901 34.17632968 0.53659649 0.00000000 0.00000000 0.00000000 902 12.81613962 0.35633515 0.00000000 0.00000000 0.00000000 903 6.84710298 0.00000000 0.33900693 0.00000000 0.00000000 904 2.77173639 0.00000000 0.56809365 0.00000000 0.00000000 905 1.14584182 0.00000000 0.27246540 0.00000000 0.00000000 906 0.30679632 0.00000000 0.00000000 1.00000000 0.00000000 907 0.08928364 0.00000000 0.00000000 0.00000000 1.00000000 908$ D-TYPE FUNCTIONS 909 6 3 0 910 74.78216818 0.02575586 0.00000000 0.00000000 911 21.31084976 0.14536816 0.00000000 0.00000000 912 7.34647924 0.37134210 0.00000000 0.00000000 913 2.56562714 0.48002998 0.00000000 0.00000000 914 0.81981773 0.00000000 0.28978791 0.00000000 915 0.24600000 0.00000000 0.00000000 1.00000000 916a 33 917$ ARSENIC (14s,10p,5d) -> [5s,4p,2d] 918$ ARSENIC (1d) 919$ S-TYPE FUNCTIONS 920 14 5 0 921 100146.52550 0.00142583 0.00000000 0.00000000 0.00000000 0.00000000 922 15036.86171 0.01093018 0.00000000 0.00000000 0.00000000 0.00000000 923 3421.29028300 0.05429417 0.00000000 0.00000000 0.00000000 0.00000000 924 966.16965720 0.18976078 0.00000000 0.00000000 0.00000000 0.00000000 925 314.87394030 0.38775195 0.00000000 0.00000000 0.00000000 0.00000000 926 108.70823790 0.30402812 0.00000000 0.00000000 0.00000000 0.00000000 927 209.54238950 0.00000000 -0.11162094 0.00000000 0.00000000 0.00000000 928 25.03822114 0.00000000 0.64697608 0.00000000 0.00000000 0.00000000 929 10.39096434 0.00000000 0.44223609 0.00000000 0.00000000 0.00000000 930 18.55509009 0.00000000 0.00000000 -0.22994191 0.00000000 0.00000000 931 3.12812175 0.00000000 0.00000000 0.73319108 0.00000000 0.00000000 932 1.38848851 0.00000000 0.00000000 0.45533654 0.00000000 0.00000000 933 0.24714362 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 934 0.09142943 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 935$ P-TYPE FUNCTIONS 936 10 4 0 937 1355.64435100 0.00891825 0.00000000 0.00000000 0.00000000 938 319.99929270 0.06745475 0.00000000 0.00000000 0.00000000 939 101.67734090 0.26759772 0.00000000 0.00000000 0.00000000 940 36.88632384 0.53776845 0.00000000 0.00000000 0.00000000 941 13.86111591 0.35992570 0.00000000 0.00000000 0.00000000 942 7.42606669 0.00000000 0.34036850 0.00000000 0.00000000 943 3.03162472 0.00000000 0.57030149 0.00000000 0.00000000 944 1.27830783 0.00000000 0.26606170 0.00000000 0.00000000 945 0.37568503 0.00000000 0.00000000 1.00000000 0.00000000 946 0.11394805 0.00000000 0.00000000 0.00000000 1.00000000 947$ D-TYPE FUNCTIONS 948 6 3 0 949 84.44551454 0.02451840 0.00000000 0.00000000 950 24.19041610 0.14107455 0.00000000 0.00000000 951 8.40450151 0.36875229 0.00000000 0.00000000 952 2.98089708 0.48409561 0.00000000 0.00000000 953 0.97909243 0.00000000 0.28250269 0.00000000 954 0.29300000 0.00000000 0.00000000 1.00000000 955a 34 956$ SELENIUM (14s,10p,5d) -> [5s,4p,2d] 957$ SELENIUM (1d) 958$ S-TYPE FUNCTIONS 959 14 5 0 960 106612.20030 0.00142749 0.00000000 0.00000000 0.00000000 0.00000000 961 16007.60470 0.01094353 0.00000000 0.00000000 0.00000000 0.00000000 962 3642.16997100 0.05437417 0.00000000 0.00000000 0.00000000 0.00000000 963 1028.59129900 0.19018093 0.00000000 0.00000000 0.00000000 0.00000000 964 335.30298890 0.38913022 0.00000000 0.00000000 0.00000000 0.00000000 965 115.80129150 0.30620207 0.00000000 0.00000000 0.00000000 0.00000000 966 222.93325020 0.00000000 -0.11198808 0.00000000 0.00000000 0.00000000 967 26.72625793 0.00000000 0.64752124 0.00000000 0.00000000 0.00000000 968 11.12450192 0.00000000 0.44241977 0.00000000 0.00000000 0.00000000 969 19.88852006 0.00000000 0.00000000 -0.22857228 0.00000000 0.00000000 970 3.36684738 0.00000000 0.00000000 0.73591360 0.00000000 0.00000000 971 1.52492778 0.00000000 0.00000000 0.44330200 0.00000000 0.00000000 972 0.29630038 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 973 0.11009289 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 974$ P-TYPE FUNCTIONS 975 10 4 0 976 1455.90681200 0.00882036 0.00000000 0.00000000 0.00000000 977 343.75101830 0.06687585 0.00000000 0.00000000 0.00000000 978 109.29554960 0.26640578 0.00000000 0.00000000 0.00000000 979 39.70771102 0.53834928 0.00000000 0.00000000 0.00000000 980 14.95018523 0.36303282 0.00000000 0.00000000 0.00000000 981 8.02089621 0.00000000 0.34153807 0.00000000 0.00000000 982 3.29346498 0.00000000 0.57257907 0.00000000 0.00000000 983 1.40586024 0.00000000 0.25549813 0.00000000 0.00000000 984 0.45076123 0.00000000 0.00000000 1.00000000 0.00000000 985 0.13353413 0.00000000 0.00000000 0.00000000 1.00000000 986$ D-TYPE FUNCTIONS 987 6 3 0 988 94.49402404 0.02349010 0.00000000 0.00000000 989 27.18818526 0.13747736 0.00000000 0.00000000 990 9.50915673 0.36649929 0.00000000 0.00000000 991 3.41705169 0.48750990 0.00000000 0.00000000 992 1.14795901 0.00000000 0.27657943 0.00000000 993 0.33800000 0.00000000 0.00000000 1.00000000 994a 35 995$ BROMINE (14s,10p,5d) -> [5s,4p,2d] 996$ BROMINE (1d) 997$ S-TYPE FUNCTIONS 998 14 5 0 999 113286.38780 0.00142830 0.00000000 0.00000000 0.00000000 0.00000000 1000 17009.62630 0.01095042 0.00000000 0.00000000 0.00000000 0.00000000 1001 3870.18425700 0.05442101 0.00000000 0.00000000 0.00000000 0.00000000 1002 1093.03572300 0.19047908 0.00000000 0.00000000 0.00000000 0.00000000 1003 356.39721800 0.39024643 0.00000000 0.00000000 0.00000000 0.00000000 1004 123.12539640 0.30814433 0.00000000 0.00000000 0.00000000 0.00000000 1005 236.74084010 0.00000000 -0.11228066 0.00000000 0.00000000 0.00000000 1006 28.46866107 0.00000000 0.64775962 0.00000000 0.00000000 0.00000000 1007 11.88344372 0.00000000 0.44235576 0.00000000 0.00000000 0.00000000 1008 21.26963331 0.00000000 0.00000000 -0.22642576 0.00000000 0.00000000 1009 3.61292268 0.00000000 0.00000000 0.73823712 0.00000000 0.00000000 1010 1.66266490 0.00000000 0.00000000 0.42683869 0.00000000 0.00000000 1011 0.34823793 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 1012 0.13019031 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 1013$ P-TYPE FUNCTIONS 1014 10 4 0 1015 1560.28018800 0.00871667 0.00000000 0.00000000 0.00000000 1016 368.47859200 0.06624364 0.00000000 0.00000000 0.00000000 1017 117.22978850 0.26495610 0.00000000 0.00000000 0.00000000 1018 42.64890925 0.53839161 0.00000000 0.00000000 0.00000000 1019 16.08722510 0.36579388 0.00000000 0.00000000 0.00000000 1020 8.63528101 0.00000000 0.34248787 0.00000000 0.00000000 1021 3.56136655 0.00000000 0.57500678 0.00000000 0.00000000 1022 1.52926266 0.00000000 0.24330394 0.00000000 0.00000000 1023 0.53064295 0.00000000 0.00000000 1.00000000 0.00000000 1024 0.15702759 0.00000000 0.00000000 0.00000000 1.00000000 1025$ D-TYPE FUNCTIONS 1026 6 3 0 1027 104.85518640 0.02265015 0.00000000 0.00000000 1028 30.28114369 0.13455483 0.00000000 0.00000000 1029 10.65139427 0.36474455 0.00000000 0.00000000 1030 3.86994562 0.49044587 0.00000000 0.00000000 1031 1.32408768 0.00000000 0.27137289 0.00000000 1032 0.38900000 0.00000000 0.00000000 1.00000000 1033a 36 1034$ KRYPTON (14s,10p,5d) -> [5s,4p,2d] 1035$ KRYPTON (1d) 1036$ S-TYPE FUNCTIONS 1037 14 5 0 1038 120165.64880 0.00142942 0.00000000 0.00000000 0.00000000 0.00000000 1039 18042.50017 0.01095960 0.00000000 0.00000000 0.00000000 0.00000000 1040 4105.18003900 0.05447965 0.00000000 0.00000000 0.00000000 0.00000000 1041 1159.44472500 0.19081239 0.00000000 0.00000000 0.00000000 0.00000000 1042 378.13810350 0.39140446 0.00000000 0.00000000 0.00000000 0.00000000 1043 130.67610050 0.31007347 0.00000000 0.00000000 0.00000000 0.00000000 1044 250.96373350 0.00000000 -0.11258604 0.00000000 0.00000000 0.00000000 1045 30.26593038 0.00000000 0.64816323 0.00000000 0.00000000 0.00000000 1046 12.66811076 0.00000000 0.44240239 0.00000000 0.00000000 0.00000000 1047 22.69794010 0.00000000 0.00000000 -0.22391965 0.00000000 0.00000000 1048 3.86730174 0.00000000 0.00000000 0.74060953 0.00000000 0.00000000 1049 1.80137067 0.00000000 0.00000000 0.40803658 0.00000000 0.00000000 1050 0.40308639 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 1051 0.15170528 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 1052$ P-TYPE FUNCTIONS 1053 10 4 0 1054 1668.57366200 0.00862150 0.00000000 0.00000000 0.00000000 1055 394.13862800 0.06566551 0.00000000 0.00000000 0.00000000 1056 125.46644850 0.26366577 0.00000000 0.00000000 0.00000000 1057 45.70499273 0.53867659 0.00000000 0.00000000 0.00000000 1058 17.27013323 0.36865168 0.00000000 0.00000000 0.00000000 1059 9.26994878 0.00000000 0.34346189 0.00000000 0.00000000 1060 3.83646177 0.00000000 0.57784776 0.00000000 0.00000000 1061 1.64671633 0.00000000 0.23075615 0.00000000 0.00000000 1062 0.61479686 0.00000000 0.00000000 1.00000000 0.00000000 1063 0.18319467 0.00000000 0.00000000 0.00000000 1.00000000 1064$ D-TYPE FUNCTIONS 1065 6 3 0 1066 115.55868600 0.02194549 0.00000000 0.00000000 1067 33.47798586 0.13211213 0.00000000 0.00000000 1068 11.83445021 0.36333307 0.00000000 0.00000000 1069 4.34082549 0.49300484 0.00000000 0.00000000 1070 1.50792732 0.00000000 0.26676859 0.00000000 1071 0.44300000 0.00000000 0.00000000 1.00000000 1072 1073 1074 1075