Orca 5.0.2 RELEASE 1 2 3 4 5 14s9p3d1f 14s9p3d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s5p3d1f 5s5p3d1f 5s3p2d1f 5s3p2d1f 3s2p1d 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 S S P O O C C C C C C C C H H H H H H H H H H H H H H H H H H H 1 1 2 3 3 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 223.18816099999987 AuxInfo=1/0/N:10,11,13,8,9,12,6,7,5,4,3,1,2/E:(1,2)(4,5)(7,8)(12,13)/CRV:9.1,11.4/rA:32nSSP4OO1CCCCCCCCHHHHHHHHHHHHHHHHHHH/rB:;s1s2;s3;s3;s1;s2;s6;s7;s8;s9;s4;s12;s6;s6;s7;s7;s8;s8;s9;s9;s10;s10;s10;s11;s11;s11;s12;s12;s13;s13;s13;/rC:1.3259,.2607,1.3991;-1.012,.9762,-.9237;.2731,-.5081,-.2239;-.5954,-1.5779,.5983;1.0537,-1.0057,-1.3741;2.4456,1.3822,.4834;-1.9274,1.491,.5732;3.6913,.6784,-.0287;-3.1416,.6389,.904;4.6276,1.6469,-.738;-4.1867,.5998,-.199;-.9705,-2.8244,-.0103;-2.0342,-2.6667,-1.0743;2.7017,2.1681,1.1957;1.8855,1.8588,-.324;-2.2279,2.5193,.3624;-1.2235,1.5298,1.4065;4.2073,.2073,.8104;3.3978,-.1226,-.7068;-2.8204,-.3709,1.1593;-3.5857,1.0534,1.8137;5.5194,1.1321,-1.0945;4.9549,2.4508,-.0767;4.1465,2.1037,-1.6037;-4.5541,1.5999,-.4354;-5.0447,-.003,.0982;-3.7824,.1728,-1.1171;-1.335,-3.4365,.8135;-.0848,-3.3108,-.4226;-2.9234,-2.1703,-.686;-1.6681,-2.1015,-1.9307;-2.3317,-3.6532,-1.4323; Method DFT(GTOs) Exchange WB97X-D3 Correlation WB97X-D3 PostSCFGGA off Hybrid DFT is turned on ScalHFX 0.195728 ScalDFX 0.000000 ScalDFC 1.000000 ScalLDAC 1.000000 Perturbative correction 0.000000 Density functional embedding theory OFF Long-range corrected/Screened/Range-Separated Hybrid DFT is turned on Amount of maximum screened exact exchange 0.804272 Range separation parameter mu (erf(mu*r12)/r12) 0.250000 RI-approximation to the Coulomb term is turned on functions 852 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 130 Dim 702 ENuc 1296.8319795629 Eh CNVDIIS on DIISMaxIt 12 DIISStart 0.200000 DIISMaxEq 5 DIISBfac 1.050 DIISMaxC 10.000 CNVTRAH auto Auto Start mean grad. ratio tolernc. 1.125000 Auto Start start iteration 1 Auto Start num. interpolation iter. 10 iterations 16 iterations Maxiter - #DIIS iter Number of Davidson start vectors 2 Converg. threshold I (grad. norm) 1.000e-04 Converg. threshold II (energy diff.) 1.000e-07 Micro threshold 0.100 Minimum threshold for Micro iter. 0.010 NR start threshold (gradient norm) 0.001 Initial trust radius 0.400 Minimum AH scaling param. (alpha) 1.000 Maximum AH scaling param. (alpha) 1000.000 Orbital update algorithm Taylor David. guess on Maximum white noise 0.010 Quad. conv. algorithm NR CNVSOSCF off CNVShift on LevelShift 0.2500 ShiftErr 0.0010 CNVZerner off CNVDamp on DampFac 0.7000 DampMax 0.9800 DampMin 0.0000 DampErr 0.1000 CNVRico off MaxIter 125 SCFMode Direct Integral package SHARK and LIBINT hybrid scheme DirectResetFreq 20 Thresh 3.000e-11 Eh TCut 1.000e-12 Eh ConvCheckMode Total+1el-Energy ConvForced 0 TolE 1.000e-07 Eh 1-El. energy change 1.000e-04 Eh TolErr 1.000e-07 Smallest eigenvalue 1.578e-04 Time for diagonalization 0.339 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.289 sec Total time needed 0.633 sec 16 16 15 8 8 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 223.18816099999987 AuxInfo=1/0/N:10,11,13,8,9,12,6,7,5,4,3,1,2/E:(1,2)(4,5)(7,8)(12,13)/CRV:9.1,11.4/rA:32nSSP4OO1CCCCCCCCHHHHHHHHHHHHHHHHHHH/rB:;s1s2;s3;s3;s1;s2;s6;s7;s8;s9;s4;s12;s6;s6;s7;s7;s8;s8;s9;s9;s10;s10;s10;s11;s11;s11;s12;s12;s13;s13;s13;/rC:1.3259,.2607,1.3991;-1.012,.9762,-.9237;.2731,-.5081,-.2239;-.5954,-1.5779,.5983;1.0538,-1.0057,-1.3741;2.4456,1.3822,.4834;-1.9274,1.491,.5732;3.6913,.6784,-.0287;-3.1416,.6389,.904;4.6276,1.6469,-.738;-4.1867,.5998,-.199;-.9705,-2.8244,-.0103;-2.0342,-2.6667,-1.0743;2.7017,2.1681,1.1957;1.8855,1.8588,-.324;-2.2279,2.5193,.3624;-1.2235,1.5298,1.4065;4.2073,.2073,.8104;3.3978,-.1226,-.7068;-2.8204,-.3709,1.1593;-3.5857,1.0534,1.8137;5.5194,1.1321,-1.0945;4.9549,2.4508,-.0767;4.1465,2.1037,-1.6037;-4.5541,1.5999,-.4354;-5.0447,-.003,.0982;-3.7824,.1728,-1.1171;-1.335,-3.4365,.8135;-.0848,-3.3108,-.4226;-2.9234,-2.1703,-.686;-1.6681,-2.1015,-1.9307;-2.3317,-3.6532,-1.4323; 0 1 wb97x-d3 def2-TZVPP def2/J RIJCOSX DEFGRID2 scfconv7 smallprint printgap noloewdin NOSOSCF MaxCore 8000 %output print[P_BondOrder_M] 1 print[P_Mayer] 1 print[P_basis] 2 pal nprocs 4 223.18816099999987 AuxInfo=1/0/N:10,11,13,8,9,12,6,7,5,4,3,1,2/E:(1,2)(4,5)(7,8)(12,13)/CRV:9.1,11.4/rA:32nSSP4OO1CCCCCCCCHHHHHHHHHHHHHHHHHHH/rB:;s1s2;s3;s3;s1;s2;s6;s7;s8;s9;s4;s12;s6;s6;s7;s7;s8;s8;s9;s9;s10;s10;s10;s11;s11;s11;s12;s12;s13;s13;s13;/rC:1.3259,.2607,1.3991;-1.012,.9762,-.9237;.2731,-.5081,-.2239;-.5954,-1.5779,.5983;1.0537,-1.0057,-1.3741;2.4456,1.3822,.4834;-1.9274,1.491,.5732;3.6913,.6784,-.0287;-3.1416,.6389,.904;4.6276,1.6469,-.738;-4.1867,.5998,-.199;-.9705,-2.8244,-.0103;-2.0342,-2.6667,-1.0743;2.7017,2.1681,1.1957;1.8855,1.8588,-.324;-2.2279,2.5193,.3624;-1.2235,1.5298,1.4065;4.2073,.2073,.8104;3.3978,-.1226,-.7068;-2.8204,-.3709,1.1593;-3.5857,1.0534,1.8137;5.5194,1.1321,-1.0945;4.9549,2.4508,-.0767;4.1465,2.1037,-1.6037;-4.5541,1.5999,-.4354;-5.0447,-.003,.0982;-3.7824,.1728,-1.1171;-1.335,-3.4365,.8135;-.0848,-3.3108,-.4226;-2.9234,-2.1703,-.686;-1.6681,-2.1015,-1.9307;-2.3317,-3.6532,-1.4323; -1604.67161778 1296.83197956 -2901.50359735 -4787.18008483 1885.67648749 -3205.03003864 1600.35842085 2.00269514 65.000234251623 65.000234251623 130.000468503247 -101.622315643192 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -2420.5874 -2420.5340 -2102.4278 -524.3431 -522.2760 -281.4370 -280.6713 -280.6375 -279.7776 -279.5495 -279.5088 -279.3889 -279.2837 -219.1368 -219.0807 -183.7481 -163.4436 -163.3880 -163.3554 -163.2970 -163.2259 -163.1717 -133.4924 -133.4683 -133.4234 -32.2142 -29.5392 -25.6250 -25.3762 -24.3002 -23.5964 -23.2662 -21.6097 -20.9879 -20.4366 -19.1112 -19.0540 -17.7852 -16.4468 -16.0401 -15.8288 -15.5488 -15.2492 -14.8954 -14.4650 -14.3401 -14.0401 -13.8065 -13.5722 -13.2995 -13.1572 -12.8714 -12.6526 -12.3665 -12.1296 -12.0735 -11.9294 -11.7396 -11.6379 -11.3862 -10.9360 -10.7601 -9.9828 -9.6179 -9.0995 1.8585 2.2802 3.0607 3.1432 3.5545 3.6332 3.7568 3.9458 4.0904 4.1940 4.4777 4.5855 4.6711 4.8418 4.9451 5.1278 5.2117 5.2903 5.4556 5.6984 5.9043 5.9310 6.0410 6.0957 6.2877 6.4275 6.5385 6.6954 7.0286 7.3633 7.5384 7.7447 7.9252 7.9905 8.1691 8.3336 8.4803 8.6654 8.8600 8.9086 9.0743 9.1846 9.3451 9.5859 9.7642 9.9440 10.4414 10.4600 10.7730 11.1748 11.2793 11.4322 11.5697 12.0551 12.0873 12.1668 12.4911 12.7834 12.9121 13.0314 13.1465 13.3306 13.4090 13.5221 13.5982 13.7517 13.9089 14.1468 14.1753 14.2756 14.3368 14.4287 14.6341 14.7444 14.8290 14.9187 15.0111 15.0789 15.2579 15.3879 15.4893 15.6372 15.6535 15.8323 15.8641 16.1336 16.5417 16.6549 17.0048 17.1157 17.2767 17.5363 17.8559 18.1143 18.2377 18.4935 18.6615 18.7178 18.9020 18.9728 19.3957 19.5209 19.6541 19.9843 20.3201 20.6876 20.9652 21.3067 21.6944 21.9855 22.0471 22.2996 22.4693 22.7309 23.2616 23.6418 23.7864 24.1209 24.2394 24.5208 24.6322 24.7794 25.0381 25.3137 25.7513 25.9596 26.1404 26.2440 26.8140 26.9361 27.0585 27.3109 27.5898 27.9142 28.1590 28.2611 28.6011 28.6873 28.8315 28.9785 29.3780 29.4917 29.6906 29.9389 30.0416 30.2335 30.3861 30.6798 30.7952 31.1325 31.3545 31.5432 31.6947 31.8882 32.1799 32.2858 32.5058 32.5939 32.9932 33.1188 33.3758 33.6082 33.6979 33.9753 34.0089 34.2929 34.4676 34.6079 34.8887 35.0006 35.2248 35.3203 35.7072 35.8627 36.1195 36.4902 36.5315 36.6646 37.4268 37.4550 37.7807 38.0908 38.3906 38.7281 38.9539 39.3438 39.3907 39.5818 39.7286 39.9552 40.2528 40.2866 40.7048 40.8374 41.1016 41.2793 41.4910 41.7327 41.7958 41.9575 42.1047 42.2623 42.4097 42.5212 42.6894 42.7443 42.8037 42.9827 43.0377 43.2201 43.2942 43.6080 43.6602 44.0913 44.2539 44.6885 44.7901 44.8909 45.1653 45.3440 45.4118 45.5583 45.8777 45.9333 46.2321 46.3788 46.5142 46.6980 47.0972 47.1516 47.3310 47.6444 47.7473 47.9889 48.5022 48.7738 48.9038 48.9200 49.0953 49.3961 49.6724 50.3009 50.5567 51.7621 52.1972 52.2757 52.7301 53.2040 53.3913 53.6011 53.8862 54.4428 54.6069 54.9232 55.0453 55.6312 55.9527 56.4838 56.6602 56.9007 57.7823 57.8470 57.9571 58.1575 58.5482 59.1414 59.2868 59.4969 59.9776 60.1978 60.3973 60.9733 61.1271 61.6258 61.8995 62.1131 62.8026 63.3249 63.8849 64.4252 64.6771 65.4901 65.7333 65.8685 66.2279 66.6008 67.3757 67.7659 68.1466 68.6550 69.0304 69.3894 69.5475 69.7682 70.3225 70.5820 70.8844 71.0802 71.3263 71.6989 71.9044 71.9587 72.1195 72.6062 73.0793 73.2321 73.5419 73.8979 74.0809 74.5017 74.6515 75.1470 75.4685 75.5640 76.2098 76.5993 76.7530 77.3433 77.8523 78.0670 78.8064 78.9077 79.3798 79.6023 79.8633 80.2697 80.4942 80.7436 80.9327 81.0523 81.2042 81.3795 81.4207 81.8352 81.8995 82.3809 82.8170 82.9732 83.3349 83.7948 84.0206 84.2388 84.7934 84.8961 85.0441 85.2411 85.4753 85.6046 85.7045 85.8754 85.9656 86.0326 86.4014 86.6672 87.0787 87.1314 87.2207 87.3552 87.5917 88.0175 88.0531 88.4253 88.4741 88.7129 89.1988 89.3057 89.4403 89.6189 89.9074 90.0077 90.1305 90.3026 90.3750 90.6459 90.7537 91.1976 91.5072 92.0246 92.5480 92.7347 92.7528 93.3608 93.8869 94.1951 94.4505 94.6496 95.1492 95.4873 96.1115 96.6033 97.0931 97.4110 97.6243 97.6890 97.8837 98.1446 98.7129 98.9503 99.0969 99.5340 99.7951 99.9973 100.1177 100.2765 100.8232 100.9478 101.4407 101.5151 101.8429 101.9365 102.0953 102.2403 102.3968 102.6759 103.2704 103.5871 103.8365 104.0871 104.3424 104.6981 105.0501 105.1813 106.1190 106.5913 106.8943 107.2255 107.2936 107.5971 107.6849 107.8025 108.2075 108.2357 108.7371 108.8585 108.9439 109.2040 109.4935 109.7035 110.2427 110.2615 110.3511 110.4891 110.9319 111.0758 111.7526 111.8611 111.9866 112.0762 112.3781 112.7195 113.0126 113.2319 113.4741 113.7253 113.7541 113.8850 114.0233 114.2125 114.4526 114.6586 114.8225 115.2031 115.3023 115.6282 115.7218 116.1213 116.5340 116.6203 116.7833 117.1626 117.9071 118.2074 118.5130 118.5849 118.9580 119.0628 119.5372 119.6491 119.8291 120.2263 120.5792 120.7645 120.9437 121.3506 121.4233 121.7666 122.5514 122.6414 122.8830 123.0529 125.6497 125.9053 126.0583 126.2307 126.3270 126.7377 126.8326 127.1799 127.7974 128.0422 128.3789 129.3245 129.6846 129.8914 130.2817 130.6944 131.6465 131.9369 132.9361 133.0863 133.3168 133.3874 133.8117 134.0856 134.2013 134.4100 134.9790 135.0201 135.6884 136.0172 136.2400 137.1095 137.2227 137.5033 137.8892 137.9967 138.1409 138.5951 141.1527 141.6657 142.0768 142.4602 142.5852 143.2583 143.3062 143.6353 144.0445 144.0887 144.4962 144.8011 144.8202 145.0712 146.1469 146.4868 146.6297 147.1497 147.3177 147.4098 147.7401 148.1693 148.3079 148.4983 148.5692 148.7826 148.9186 149.3256 149.6875 150.0317 150.6860 150.7878 150.9239 151.4700 151.5756 152.4614 152.5303 152.7114 152.9850 153.1648 153.2604 153.8119 153.8628 154.0131 154.5066 154.9789 155.0576 155.2116 155.9776 156.1643 156.9028 157.2826 158.0227 158.2057 158.3140 158.3866 158.6930 159.1734 159.4443 162.8040 163.5595 164.1972 166.9234 169.2100 171.0364 175.6993 176.6127 177.2265 177.6513 183.4505 185.7388 186.4958 187.7486 187.8949 188.6166 189.1979 189.6652 190.1047 190.2064 190.6258 191.0339 191.9041 192.4085 195.3738 195.4380 198.7004 200.3909 212.5183 217.2859 235.9135 247.0718 249.2119 255.2391 256.9789 261.2312 261.5024 446.5120 527.9308 530.8573 633.4765 634.4741 636.0371 639.3773 640.2590 645.7975 645.9650 647.1755 1196.8648 1204.0333 -0.0000000 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 S S P O O C C C C C C C C H H H H H H H H H H H H H H H H H H H -0.161270 -0.152459 0.679356 -0.346936 -0.523548 -0.116492 -0.122757 -0.084028 -0.123736 -0.253232 -0.254735 0.025148 -0.260736 0.112010 0.099768 0.111191 0.115862 0.056338 0.085537 0.070911 0.075759 0.088097 0.069885 0.081267 0.083113 0.090921 0.077926 0.096049 0.104009 0.077768 0.105853 0.093158 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 S S P O O C C C C C C C C H H H H H H H H H H H H H H H H H H H 16.1613 16.1525 14.3206 8.3469 8.5235 6.1165 6.1228 6.0840 6.1237 6.2532 6.2547 5.9749 6.2607 0.8880 0.9002 0.8888 0.8841 0.9437 0.9145 0.9291 0.9242 0.9119 0.9301 0.9187 0.9169 0.9091 0.9221 0.9040 0.8960 0.9222 0.8941 0.9068 16.0000 16.0000 15.0000 8.0000 8.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 -0.1613 -0.1525 0.6794 -0.3469 -0.5235 -0.1165 -0.1228 -0.0840 -0.1237 -0.2532 -0.2547 0.0251 -0.2607 0.1120 0.0998 0.1112 0.1159 0.0563 0.0855 0.0709 0.0758 0.0881 0.0699 0.0813 0.0831 0.0909 0.0779 0.0960 0.1040 0.0778 0.1059 0.0932 2.2960 2.2797 5.4208 2.0821 2.1044 3.8969 3.8628 3.8728 3.8895 3.9512 3.9206 3.8722 3.9147 1.0066 1.0305 1.0075 1.0384 1.0153 1.0332 1.0211 1.0121 1.0064 1.0027 1.0030 1.0061 1.0036 1.0136 0.9896 1.0075 0.9973 1.0118 1.0162 2.2960 2.2797 5.4208 2.0821 2.1044 3.8969 3.8628 3.8728 3.8895 3.9512 3.9206 3.8722 3.9147 1.0066 1.0305 1.0075 1.0384 1.0153 1.0332 1.0211 1.0121 1.0064 1.0027 1.0030 1.0061 1.0036 1.0136 0.9896 1.0075 0.9973 1.0118 1.0162 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1.1271 0.9580 1.1192 0.9454 1.1260 1.9377 0.8763 0.9452 0.9783 0.9859 0.9421 0.9789 0.9810 0.9393 0.9995 0.9925 0.9386 1.0019 0.9914 0.9938 0.9928 0.9952 0.9910 0.9945 0.9902 0.9523 0.9810 0.9949 0.9876 0.9836 0.9879 0 2 0 5 1 2 1 6 2 3 2 4 3 11 5 7 5 13 5 14 6 8 6 15 6 16 7 9 7 17 7 18 8 10 8 19 8 20 9 21 9 22 9 23 10 24 10 25 10 26 11 12 11 27 11 28 12 29 12 30 12 31 -0.014623658 -1604.686241441451 -4.93495 4.23581 -0.69915 2.21458 -1.95323 0.26135 -1.34710 2.06074 0.71364 1.03267 2.62483