NBasis: 830 HOMO: 157 Groups: 0 MO eV Symmetry 830 L+672 134.76 A 829 L+671 134.35 A 828 L+670 132.9 A 827 L+669 132.72 A 826 L+668 131.04 A 825 L+667 130.12 A 824 L+666 129.8 A 823 L+665 129.08 A 822 L+664 128.88 A 821 L+663 128.03 A 820 L+662 126.39 A 819 L+661 125.65 A 818 L+660 124.93 A 817 L+659 124.64 A 816 L+658 123.52 A 815 L+657 122.97 A 814 L+656 121.38 A 813 L+655 120.68 A 812 L+654 120.38 A 811 L+653 119.8 A 810 L+652 119.43 A 809 L+651 118.48 A 808 L+650 117.48 A 807 L+649 116.93 A 806 L+648 116.61 A 805 L+647 116.02 A 804 L+646 114.76 A 803 L+645 114.34 A 802 L+644 113.02 A 801 L+643 112.53 A 800 L+642 111.89 A 799 L+641 111.45 A 798 L+640 111.37 A 797 L+639 110.09 A 796 L+638 109.91 A 795 L+637 107.6 A 794 L+636 107.25 A 793 L+635 106.77 A 792 L+634 106.41 A 791 L+633 105.87 A 790 L+632 97.43 A 789 L+631 97.16 A 788 L+630 96.78 A 787 L+629 96.62 A 786 L+628 96.38 A 785 L+627 95.97 A 784 L+626 95.6 A 783 L+625 95.33 A 782 L+624 95.29 A 781 L+623 95.22 A 780 L+622 94.94 A 779 L+621 94.79 A 778 L+620 94.54 A 777 L+619 94.22 A 776 L+618 94.18 A 775 L+617 94.08 A 774 L+616 93.88 A 773 L+615 93.6 A 772 L+614 93.48 A 771 L+613 93.4 A 770 L+612 93.34 A 769 L+611 93.31 A 768 L+610 93.09 A 767 L+609 92.77 A 766 L+608 92.67 A 765 L+607 92.57 A 764 L+606 92.4 A 763 L+605 92.25 A 762 L+604 91.97 A 761 L+603 91.89 A 760 L+602 91.55 A 759 L+601 91.47 A 758 L+600 90.82 A 757 L+599 90.36 A 756 L+598 89.75 A 755 L+597 89.53 A 754 L+596 89.31 A 753 L+595 89.23 A 752 L+594 89.12 A 751 L+593 88.51 A 750 L+592 88.35 A 749 L+591 88.23 A 748 L+590 87.96 A 747 L+589 87.44 A 746 L+588 86.42 A 745 L+587 86.32 A 744 L+586 86.06 A 743 L+585 85.68 A 742 L+584 85.0 A 741 L+583 84.95 A 740 L+582 84.66 A 739 L+581 84.55 A 738 L+580 84.38 A 737 L+579 84.17 A 736 L+578 83.28 A 735 L+577 83.27 A 734 L+576 83.04 A 733 L+575 82.55 A 732 L+574 82.45 A 731 L+573 82.11 A 730 L+572 81.92 A 729 L+571 81.72 A 728 L+570 81.56 A 727 L+569 81.4 A 726 L+568 81.21 A 725 L+567 81.17 A 724 L+566 81.01 A 723 L+565 80.63 A 722 L+564 80.53 A 721 L+563 80.37 A 720 L+562 80.21 A 719 L+561 80.18 A 718 L+560 80.13 A 717 L+559 79.82 A 716 L+558 79.76 A 715 L+557 79.5 A 714 L+556 79.28 A 713 L+555 79.22 A 712 L+554 79.16 A 711 L+553 78.99 A 710 L+552 78.94 A 709 L+551 78.88 A 708 L+550 78.8 A 707 L+549 78.52 A 706 L+548 78.37 A 705 L+547 78.08 A 704 L+546 77.98 A 703 L+545 77.84 A 702 L+544 77.78 A 701 L+543 77.51 A 700 L+542 77.42 A 699 L+541 77.35 A 698 L+540 77.21 A 697 L+539 77.02 A 696 L+538 76.86 A 695 L+537 76.79 A 694 L+536 76.54 A 693 L+535 76.42 A 692 L+534 76.21 A 691 L+533 75.92 A 690 L+532 75.75 A 689 L+531 75.72 A 688 L+530 75.52 A 687 L+529 75.47 A 686 L+528 75.39 A 685 L+527 75.18 A 684 L+526 75.03 A 683 L+525 74.94 A 682 L+524 74.76 A 681 L+523 74.69 A 680 L+522 74.6 A 679 L+521 74.37 A 678 L+520 74.35 A 677 L+519 74.29 A 676 L+518 74.24 A 675 L+517 74.14 A 674 L+516 73.76 A 673 L+515 73.65 A 672 L+514 73.57 A 671 L+513 73.46 A 670 L+512 73.37 A 669 L+511 73.2 A 668 L+510 73.05 A 667 L+509 72.9 A 666 L+508 72.85 A 665 L+507 72.72 A 664 L+506 72.69 A 663 L+505 72.57 A 662 L+504 72.5 A 661 L+503 72.4 A 660 L+502 72.28 A 659 L+501 72.16 A 658 L+500 72.03 A 657 L+499 71.75 A 656 L+498 71.65 A 655 L+497 71.59 A 654 L+496 71.4 A 653 L+495 71.29 A 652 L+494 71.12 A 651 L+493 71.06 A 650 L+492 70.81 A 649 L+491 70.67 A 648 L+490 70.53 A 647 L+489 70.49 A 646 L+488 70.24 A 645 L+487 70.14 A 644 L+486 70.05 A 643 L+485 69.8 A 642 L+484 69.68 A 641 L+483 69.44 A 640 L+482 69.13 A 639 L+481 68.9 A 638 L+480 68.84 A 637 L+479 68.58 A 636 L+478 68.51 A 635 L+477 68.26 A 634 L+476 68.01 A 633 L+475 67.89 A 632 L+474 67.75 A 631 L+473 67.59 A 630 L+472 67.3 A 629 L+471 67.0 A 628 L+470 66.91 A 627 L+469 66.86 A 626 L+468 66.8 A 625 L+467 66.71 A 624 L+466 66.51 A 623 L+465 66.38 A 622 L+464 66.03 A 621 L+463 65.93 A 620 L+462 65.91 A 619 L+461 65.76 A 618 L+460 65.62 A 617 L+459 65.47 A 616 L+458 65.3 A 615 L+457 65.21 A 614 L+456 65.0 A 613 L+455 64.79 A 612 L+454 64.57 A 611 L+453 64.28 A 610 L+452 64.23 A 609 L+451 64.13 A 608 L+450 63.92 A 607 L+449 63.78 A 606 L+448 63.62 A 605 L+447 63.37 A 604 L+446 63.07 A 603 L+445 62.79 A 602 L+444 62.78 A 601 L+443 62.66 A 600 L+442 62.5 A 599 L+441 62.45 A 598 L+440 62.36 A 597 L+439 62.24 A 596 L+438 62.08 A 595 L+437 62.01 A 594 L+436 61.89 A 593 L+435 61.81 A 592 L+434 61.55 A 591 L+433 61.21 A 590 L+432 61.12 A 589 L+431 61.04 A 588 L+430 60.79 A 587 L+429 60.57 A 586 L+428 60.39 A 585 L+427 60.21 A 584 L+426 60.19 A 583 L+425 59.98 A 582 L+424 59.85 A 581 L+423 59.83 A 580 L+422 59.64 A 579 L+421 59.46 A 578 L+420 59.22 A 577 L+419 59.17 A 576 L+418 59.08 A 575 L+417 58.96 A 574 L+416 58.83 A 573 L+415 58.63 A 572 L+414 58.46 A 571 L+413 58.42 A 570 L+412 58.29 A 569 L+411 58.15 A 568 L+410 57.98 A 567 L+409 57.79 A 566 L+408 57.7 A 565 L+407 57.63 A 564 L+406 57.5 A 563 L+405 57.44 A 562 L+404 57.3 A 561 L+403 57.17 A 560 L+402 57.07 A 559 L+401 56.96 A 558 L+400 56.79 A 557 L+399 56.59 A 556 L+398 56.56 A 555 L+397 56.44 A 554 L+396 56.18 A 553 L+395 56.13 A 552 L+394 56.06 A 551 L+393 55.81 A 550 L+392 55.74 A 549 L+391 55.66 A 548 L+390 55.44 A 547 L+389 55.4 A 546 L+388 55.34 A 545 L+387 55.27 A 544 L+386 55.18 A 543 L+385 54.96 A 542 L+384 54.86 A 541 L+383 54.62 A 540 L+382 54.58 A 539 L+381 54.46 A 538 L+380 54.27 A 537 L+379 54.13 A 536 L+378 54.07 A 535 L+377 53.98 A 534 L+376 53.97 A 533 L+375 53.92 A 532 L+374 53.61 A 531 L+373 53.57 A 530 L+372 53.43 A 529 L+371 53.3 A 528 L+370 53.07 A 527 L+369 52.76 A 526 L+368 52.71 A 525 L+367 52.6 A 524 L+366 52.5 A 523 L+365 52.25 A 522 L+364 52.16 A 521 L+363 52.0 A 520 L+362 51.72 A 519 L+361 51.66 A 518 L+360 51.63 A 517 L+359 51.46 A 516 L+358 51.3 A 515 L+357 51.29 A 514 L+356 51.2 A 513 L+355 51.01 A 512 L+354 50.92 A 511 L+353 50.85 A 510 L+352 50.69 A 509 L+351 50.48 A 508 L+350 50.32 A 507 L+349 50.21 A 506 L+348 50.19 A 505 L+347 50.13 A 504 L+346 49.96 A 503 L+345 49.7 A 502 L+344 49.54 A 501 L+343 49.47 A 500 L+342 49.37 A 499 L+341 49.08 A 498 L+340 49.0 A 497 L+339 48.9 A 496 L+338 48.68 A 495 L+337 48.58 A 494 L+336 48.23 A 493 L+335 48.03 A 492 L+334 47.9 A 491 L+333 47.75 A 490 L+332 47.63 A 489 L+331 47.52 A 488 L+330 47.5 A 487 L+329 47.34 A 486 L+328 47.09 A 485 L+327 46.83 A 484 L+326 46.6 A 483 L+325 46.56 A 482 L+324 46.3 A 481 L+323 46.27 A 480 L+322 45.94 A 479 L+321 45.89 A 478 L+320 45.74 A 477 L+319 45.54 A 476 L+318 45.37 A 475 L+317 45.33 A 474 L+316 45.24 A 473 L+315 44.92 A 472 L+314 44.71 A 471 L+313 44.59 A 470 L+312 44.45 A 469 L+311 44.22 A 468 L+310 44.15 A 467 L+309 43.91 A 466 L+308 43.8 A 465 L+307 43.64 A 464 L+306 43.48 A 463 L+305 43.29 A 462 L+304 43.19 A 461 L+303 42.96 A 460 L+302 42.76 A 459 L+301 42.72 A 458 L+300 42.5 A 457 L+299 42.42 A 456 L+298 42.35 A 455 L+297 42.22 A 454 L+296 41.91 A 453 L+295 41.81 A 452 L+294 41.64 A 451 L+293 41.63 A 450 L+292 41.42 A 449 L+291 41.31 A 448 L+290 41.16 A 447 L+289 40.87 A 446 L+288 40.77 A 445 L+287 40.56 A 444 L+286 40.48 A 443 L+285 40.14 A 442 L+284 40.11 A 441 L+283 39.95 A 440 L+282 39.58 A 439 L+281 39.26 A 438 L+280 39.06 A 437 L+279 38.78 A 436 L+278 38.62 A 435 L+277 38.4 A 434 L+276 38.22 A 433 L+275 37.97 A 432 L+274 37.73 A 431 L+273 37.27 A 430 L+272 37.18 A 429 L+271 36.94 A 428 L+270 36.65 A 427 L+269 36.56 A 426 L+268 36.33 A 425 L+267 36.15 A 424 L+266 36.09 A 423 L+265 35.85 A 422 L+264 35.76 A 421 L+263 35.31 A 420 L+262 35.08 A 419 L+261 34.84 A 418 L+260 34.77 A 417 L+259 34.58 A 416 L+258 34.5 A 415 L+257 34.21 A 414 L+256 34.03 A 413 L+255 33.88 A 412 L+254 33.78 A 411 L+253 33.49 A 410 L+252 33.27 A 409 L+251 33.07 A 408 L+250 33.02 A 407 L+249 32.79 A 406 L+248 32.54 A 405 L+247 32.41 A 404 L+246 32.28 A 403 L+245 32.06 A 402 L+244 31.91 A 401 L+243 31.63 A 400 L+242 31.57 A 399 L+241 31.45 A 398 L+240 31.27 A 397 L+239 30.97 A 396 L+238 30.79 A 395 L+237 30.75 A 394 L+236 30.52 A 393 L+235 30.29 A 392 L+234 30.04 A 391 L+233 29.94 A 390 L+232 29.92 A 389 L+231 29.64 A 388 L+230 29.58 A 387 L+229 29.44 A 386 L+228 29.28 A 385 L+227 29.06 A 384 L+226 28.9 A 383 L+225 28.82 A 382 L+224 28.49 A 381 L+223 28.36 A 380 L+222 28.23 A 379 L+221 28.1 A 378 L+220 27.88 A 377 L+219 27.82 A 376 L+218 27.68 A 375 L+217 27.44 A 374 L+216 27.33 A 373 L+215 27.09 A 372 L+214 26.88 A 371 L+213 26.67 A 370 L+212 26.51 A 369 L+211 26.39 A 368 L+210 26.3 A 367 L+209 26.09 A 366 L+208 26.04 A 365 L+207 25.98 A 364 L+206 25.87 A 363 L+205 25.63 A 362 L+204 25.51 A 361 L+203 25.32 A 360 L+202 25.13 A 359 L+201 24.91 A 358 L+200 24.87 A 357 L+199 24.76 A 356 L+198 24.65 A 355 L+197 24.57 A 354 L+196 24.51 A 353 L+195 24.44 A 352 L+194 24.32 A 351 L+193 24.27 A 350 L+192 24.18 A 349 L+191 24.08 A 348 L+190 24.06 A 347 L+189 23.99 A 346 L+188 23.87 A 345 L+187 23.56 A 344 L+186 23.51 A 343 L+185 23.48 A 342 L+184 23.41 A 341 L+183 23.29 A 340 L+182 23.17 A 339 L+181 23.16 A 338 L+180 23.0 A 337 L+179 22.9 A 336 L+178 22.79 A 335 L+177 22.68 A 334 L+176 22.55 A 333 L+175 22.51 A 332 L+174 22.34 A 331 L+173 22.19 A 330 L+172 22.14 A 329 L+171 22.03 A 328 L+170 21.96 A 327 L+169 21.87 A 326 L+168 21.73 A 325 L+167 21.7 A 324 L+166 21.61 A 323 L+165 21.52 A 322 L+164 21.45 A 321 L+163 21.4 A 320 L+162 21.37 A 319 L+161 21.3 A 318 L+160 21.28 A 317 L+159 21.12 A 316 L+158 21.04 A 315 L+157 20.95 A 314 L+156 20.93 A 313 L+155 20.75 A 312 L+154 20.72 A 311 L+153 20.51 A 310 L+152 20.47 A 309 L+151 20.41 A 308 L+150 20.22 A 307 L+149 20.09 A 306 L+148 20.01 A 305 L+147 19.92 A 304 L+146 19.72 A 303 L+145 19.65 A 302 L+144 19.38 A 301 L+143 19.29 A 300 L+142 19.17 A 299 L+141 19.0 A 298 L+140 18.91 A 297 L+139 18.7 A 296 L+138 18.6 A 295 L+137 18.51 A 294 L+136 18.39 A 293 L+135 18.26 A 292 L+134 18.12 A 291 L+133 17.91 A 290 L+132 17.83 A 289 L+131 17.72 A 288 L+130 17.52 A 287 L+129 17.5 A 286 L+128 17.38 A 285 L+127 17.32 A 284 L+126 17.24 A 283 L+125 17.14 A 282 L+124 16.83 A 281 L+123 16.66 A 280 L+122 16.56 A 279 L+121 16.39 A 278 L+120 16.29 A 277 L+119 16.27 A 276 L+118 16.11 A 275 L+117 16.02 A 274 L+116 15.94 A 273 L+115 15.72 A 272 L+114 15.65 A 271 L+113 15.54 A 270 L+112 15.5 A 269 L+111 15.26 A 268 L+110 15.22 A 267 L+109 14.94 A 266 L+108 14.9 A 265 L+107 14.84 A 264 L+106 14.78 A 263 L+105 14.58 A 262 L+104 14.53 A 261 L+103 14.28 A 260 L+102 14.19 A 259 L+101 13.98 A 258 L+100 13.96 A 257 L+99 13.89 A 256 L+98 13.83 A 255 L+97 13.74 A 254 L+96 13.62 A 253 L+95 13.59 A 252 L+94 13.51 A 251 L+93 13.39 A 250 L+92 13.27 A 249 L+91 13.01 A 248 L+90 12.81 A 247 L+89 12.61 A 246 L+88 11.16 A 245 L+87 9.72 A 244 L+86 9.14 A 243 L+85 8.84 A 242 L+84 8.55 A 241 L+83 8.44 A 240 L+82 8.27 A 239 L+81 8.04 A 238 L+80 7.95 A 237 L+79 7.7 A 236 L+78 7.49 A 235 L+77 7.42 A 234 L+76 7.37 A 233 L+75 7.33 A 232 L+74 7.12 A 231 L+73 7.09 A 230 L+72 6.93 A 229 L+71 6.83 A 228 L+70 6.69 A 227 L+69 6.64 A 226 L+68 6.53 A 225 L+67 6.44 A 224 L+66 6.33 A 223 L+65 6.3 A 222 L+64 6.11 A 221 L+63 6.04 A 220 L+62 5.97 A 219 L+61 5.87 A 218 L+60 5.78 A 217 L+59 5.72 A 216 L+58 5.59 A 215 L+57 5.48 A 214 L+56 5.44 A 213 L+55 5.4 A 212 L+54 5.29 A 211 L+53 5.25 A 210 L+52 5.18 A 209 L+51 5.15 A 208 L+50 5.05 A 207 L+49 5.0 A 206 L+48 4.89 A 205 L+47 4.84 A 204 L+46 4.79 A 203 L+45 4.74 A 202 L+44 4.64 A 201 L+43 4.58 A 200 L+42 4.46 A 199 L+41 4.43 A 198 L+40 4.37 A 197 L+39 4.3 A 196 L+38 4.22 A 195 L+37 4.15 A 194 L+36 4.1 A 193 L+35 4.04 A 192 L+34 3.92 A 191 L+33 3.88 A 190 L+32 3.75 A 189 L+31 3.72 A 188 L+30 3.66 A 187 L+29 3.58 A 186 L+28 3.49 A 185 L+27 3.47 A 184 L+26 3.32 A 183 L+25 3.29 A 182 L+24 3.22 A 181 L+23 3.07 A 180 L+22 3.02 A 179 L+21 2.89 A 178 L+20 2.74 A 177 L+19 2.69 A 176 L+18 2.62 A 175 L+17 2.55 A 174 L+16 2.54 A 173 L+15 2.49 A 172 L+14 2.35 A 171 L+13 2.2 A 170 L+12 2.11 A 169 L+11 1.85 A 168 L+10 1.8 A 167 L+9 1.73 A 166 L+8 1.61 A 165 L+7 1.56 A 164 L+6 1.53 A 163 L+5 1.36 A 162 L+4 1.24 A 161 L+3 0.78 A 160 L+2 0.69 A 159 L+1 0.64 A 158 LUMO -0.01 A 157 HOMO -7.27 A 156 H-1 -7.37 A 155 H-2 -7.48 A 154 H-3 -7.6 A 153 H-4 -7.62 A 152 H-5 -7.8 A 151 H-6 -7.81 A 150 H-7 -7.97 A 149 H-8 -8.0 A 148 H-9 -8.22 A 147 H-10 -8.3 A 146 H-11 -8.44 A 145 H-12 -8.5 A 144 H-13 -8.67 A 143 H-14 -8.92 A 142 H-15 -9.08 A 141 H-16 -9.27 A 140 H-17 -9.49 A 139 H-18 -9.57 A 138 H-19 -9.63 A 137 H-20 -9.77 A 136 H-21 -9.79 A 135 H-22 -9.95 A 134 H-23 -10.13 A 133 H-24 -10.28 A 132 H-25 -10.39 A 131 H-26 -10.44 A 130 H-27 -10.5 A 129 H-28 -10.56 A 128 H-29 -10.64 A 127 H-30 -10.67 A 126 H-31 -10.97 A 125 H-32 -11.03 A 124 H-33 -11.11 A 123 H-34 -11.14 A 122 H-35 -11.27 A 121 H-36 -11.39 A 120 H-37 -11.46 A 119 H-38 -11.59 A 118 H-39 -11.64 A 117 H-40 -11.72 A 116 H-41 -11.78 A 115 H-42 -11.92 A 114 H-43 -11.94 A 113 H-44 -12.06 A 112 H-45 -12.33 A 111 H-46 -12.42 A 110 H-47 -12.55 A 109 H-48 -12.69 A 108 H-49 -12.82 A 107 H-50 -12.97 A 106 H-51 -13.12 A 105 H-52 -13.18 A 104 H-53 -13.38 A 103 H-54 -13.41 A 102 H-55 -13.64 A 101 H-56 -13.67 A 100 H-57 -13.76 A 99 H-58 -13.84 A 98 H-59 -13.94 A 97 H-60 -13.99 A 96 H-61 -14.28 A 95 H-62 -14.44 A 94 H-63 -14.58 A 93 H-64 -14.63 A 92 H-65 -14.73 A 91 H-66 -14.84 A 90 H-67 -15.06 A 89 H-68 -15.14 A 88 H-69 -15.21 A 87 H-70 -15.31 A 86 H-71 -15.35 A 85 H-72 -15.55 A 84 H-73 -15.78 A 83 H-74 -16.04 A 82 H-75 -16.05 A 81 H-76 -16.2 A 80 H-77 -16.4 A 79 H-78 -16.42 A 78 H-79 -16.52 A 77 H-80 -17.03 A 76 H-81 -17.19 A 75 H-82 -17.55 A 74 H-83 -17.57 A 73 H-84 -17.94 A 72 H-85 -17.97 A 71 H-86 -18.21 A 70 H-87 -18.56 A 69 H-88 -19.01 A 68 H-89 -19.3 A 67 H-90 -19.77 A 66 H-91 -20.77 A 65 H-92 -20.85 A 64 H-93 -21.47 A 63 H-94 -21.67 A 62 H-95 -21.84 A 61 H-96 -22.08 A 60 H-97 -22.38 A 59 H-98 -22.95 A 58 H-99 -24.74 A 57 H-100 -25.61 A 56 H-101 -27.16 A 55 H-102 -27.42 A 54 H-103 -27.77 A 53 H-104 -27.82 A 52 H-105 -27.82 A 51 H-106 -28.08 A 50 H-107 -28.1 A 49 H-108 -28.36 A 48 H-109 -28.42 A 47 H-110 -28.66 A 46 H-111 -28.76 A 45 H-112 -28.81 A 44 H-113 -28.89 A 43 H-114 -28.99 A 42 H-115 -29.92 A 41 H-116 -30.08 A 40 H-117 -277.89 A 39 H-118 -278.04 A 38 H-119 -278.35 A 37 H-120 -278.72 A 36 H-121 -278.86 A 35 H-122 -278.9 A 34 H-123 -278.99 A 33 H-124 -279.04 A 32 H-125 -279.13 A 31 H-126 -279.25 A 30 H-127 -279.25 A 29 H-128 -279.34 A 28 H-129 -279.36 A 27 H-130 -279.44 A 26 H-131 -279.48 A 25 H-132 -279.49 A 24 H-133 -279.51 A 23 H-134 -279.58 A 22 H-135 -279.69 A 21 H-136 -280.36 A 20 H-137 -280.51 A 19 H-138 -280.63 A 18 H-139 -390.62 A 17 H-140 -391.19 A 16 H-141 -393.12 A 15 H-142 -393.57 A 14 H-143 -393.96 A 13 H-144 -520.63 A 12 H-145 -521.21 A 11 H-146 -521.33 A 10 H-147 -521.55 A 9 H-148 -521.59 A 8 H-149 -521.76 A 7 H-150 -522.03 A 6 H-151 -522.04 A 5 H-152 -522.07 A 4 H-153 -522.08 A 3 H-154 -522.08 A 2 H-155 -522.18 A 1 H-156 -522.23 A