@MOLECULE aziridine, 2,2-dimethyl-3-(3,7,12,16,20-pentamethyl-3,7,11,15,19-heneicosapentaenyl)-, (all-e)- 82 82 0 0 0 SMALL GASTEIGER @ATOM 1 N -4.4449 -1.6169 -0.2778 N.3 1 UNL1111111111 -0.5271 2 C -4.4244 -0.8544 0.9959 C.3 1 UNL1111111111 0.1295 3 C -3.8036 -0.2863 -0.2783 C.3 1 UNL1111111111 -0.0830 4 C -4.3893 0.8942 -1.0155 C.3 1 UNL1111111111 -0.2833 5 C -3.5069 -1.4059 2.0605 C.3 1 UNL1111111111 -0.4358 6 C -5.7034 -0.2780 1.5508 C.3 1 UNL1111111111 -0.4710 7 C -3.9290 2.2068 -0.3556 C.3 1 UNL1111111111 -0.2796 8 C -2.4297 2.2706 -0.3080 C.2 1 UNL1111111111 0.0146 9 C -1.7418 2.6719 -1.5682 C.3 1 UNL1111111111 -0.4517 10 C -1.7667 1.9428 0.8100 C.2 1 UNL1111111111 -0.2057 11 C -0.2802 1.9383 0.9141 C.3 1 UNL1111111111 -0.2639 12 C 0.2039 1.1943 2.1710 C.3 1 UNL1111111111 -0.2790 13 C 1.6924 1.3446 2.2911 C.2 1 UNL1111111111 0.0146 14 C 2.5179 0.4317 1.7645 C.2 1 UNL1111111111 -0.2089 15 C 2.1639 2.5662 3.0084 C.3 1 UNL1111111111 -0.4518 16 C 4.0085 0.5252 1.7801 C.3 1 UNL1111111111 -0.2607 17 C 4.5047 1.3220 0.5552 C.3 1 UNL1111111111 -0.2560 18 C 3.9862 0.7292 -0.7139 C.2 1 UNL1111111111 -0.2194 19 C 3.2111 1.3702 -1.5992 C.2 1 UNL1111111111 0.0353 20 C 2.7343 0.6750 -2.8422 C.3 1 UNL1111111111 -0.2878 21 C 1.2113 0.4453 -2.8158 C.3 1 UNL1111111111 -0.2510 22 C 0.8051 -0.4301 -1.6791 C.2 1 UNL1111111111 -0.2302 23 C -0.3211 -1.1539 -1.6332 C.2 1 UNL1111111111 0.0301 24 C -0.6202 -2.0076 -0.4354 C.3 1 UNL1111111111 -0.2861 25 C 2.7651 2.7852 -1.4289 C.3 1 UNL1111111111 -0.4529 26 C 0.0576 -3.3865 -0.5563 C.3 1 UNL1111111111 -0.2460 27 C -1.3303 -1.1723 -2.7316 C.3 1 UNL1111111111 -0.4558 28 C 1.5453 -3.2562 -0.5957 C.2 1 UNL1111111111 -0.2160 29 C 2.3374 -3.1741 0.4806 C.2 1 UNL1111111111 0.0375 30 C 3.8205 -3.0510 0.3378 C.3 1 UNL1111111111 -0.4601 31 C 1.8376 -3.2026 1.8873 C.3 1 UNL1111111111 -0.4531 32 H -2.7008 -0.3265 -0.3753 H 1 UNL1111111111 0.1903 33 H -5.3344 -1.6990 -0.7472 H 1 UNL1111111111 0.2548 34 H -4.0553 0.8673 -2.0736 H 1 UNL1111111111 0.1507 35 H -5.4929 0.8582 -1.0495 H 1 UNL1111111111 0.1341 36 H -3.0728 -0.5970 2.6602 H 1 UNL1111111111 0.1493 37 H -2.6778 -1.9814 1.6210 H 1 UNL1111111111 0.1673 38 H -4.0389 -2.0878 2.7348 H 1 UNL1111111111 0.1504 39 H -6.2635 -1.0348 2.1165 H 1 UNL1111111111 0.1566 40 H -5.4898 0.5529 2.2369 H 1 UNL1111111111 0.1590 41 H -6.3735 0.1087 0.7753 H 1 UNL1111111111 0.1469 42 H -4.3404 3.0729 -0.9092 H 1 UNL1111111111 0.1433 43 H -4.3608 2.2775 0.6632 H 1 UNL1111111111 0.1442 44 H -2.4384 2.9217 -2.3764 H 1 UNL1111111111 0.1456 45 H -1.0970 3.5478 -1.4097 H 1 UNL1111111111 0.1535 46 H -1.0959 1.8555 -1.9350 H 1 UNL1111111111 0.1652 47 H -2.3003 1.6487 1.7111 H 1 UNL1111111111 0.1459 48 H 0.1022 2.9799 0.9195 H 1 UNL1111111111 0.1452 49 H 0.1744 1.4622 0.0143 H 1 UNL1111111111 0.1639 50 H -0.3045 1.5876 3.0723 H 1 UNL1111111111 0.1434 51 H -0.0876 0.1269 2.1076 H 1 UNL1111111111 0.1454 52 H 2.1293 -0.4453 1.2438 H 1 UNL1111111111 0.1572 53 H 1.3815 3.3311 3.0941 H 1 UNL1111111111 0.1488 54 H 2.4898 2.3182 4.0285 H 1 UNL1111111111 0.1517 55 H 3.0164 3.0371 2.5001 H 1 UNL1111111111 0.1514 56 H 4.3723 1.0066 2.7087 H 1 UNL1111111111 0.1374 57 H 4.4601 -0.4871 1.7786 H 1 UNL1111111111 0.1358 58 H 5.6135 1.3284 0.5395 H 1 UNL1111111111 0.1359 59 H 4.2020 2.3815 0.6651 H 1 UNL1111111111 0.1407 60 H 4.2797 -0.3074 -0.8720 H 1 UNL1111111111 0.1460 61 H 3.0076 1.2721 -3.7348 H 1 UNL1111111111 0.1409 62 H 3.2443 -0.3010 -2.9725 H 1 UNL1111111111 0.1460 63 H 0.6865 1.4212 -2.7415 H 1 UNL1111111111 0.1410 64 H 0.8946 0.0077 -3.7847 H 1 UNL1111111111 0.1397 65 H 1.5128 -0.4538 -0.8474 H 1 UNL1111111111 0.1639 66 H -1.7162 -2.1556 -0.3182 H 1 UNL1111111111 0.1617 67 H -0.2826 -1.5042 0.4925 H 1 UNL1111111111 0.1433 68 H 3.6206 3.4669 -1.3305 H 1 UNL1111111111 0.1507 69 H 2.1619 3.1455 -2.2708 H 1 UNL1111111111 0.1476 70 H 2.1524 2.8930 -0.5197 H 1 UNL1111111111 0.1609 71 H -0.3082 -3.8943 -1.4718 H 1 UNL1111111111 0.1393 72 H -0.2645 -4.0310 0.2853 H 1 UNL1111111111 0.1367 73 H -1.7964 -0.1856 -2.8603 H 1 UNL1111111111 0.1486 74 H -2.1445 -1.8870 -2.5424 H 1 UNL1111111111 0.1607 75 H -0.8754 -1.4516 -3.6917 H 1 UNL1111111111 0.1510 76 H 1.9614 -3.2111 -1.6006 H 1 UNL1111111111 0.1451 77 H 4.3458 -3.7890 0.9578 H 1 UNL1111111111 0.1510 78 H 4.1600 -3.1947 -0.6958 H 1 UNL1111111111 0.1494 79 H 4.1616 -2.0523 0.6525 H 1 UNL1111111111 0.1583 80 H 1.7713 -4.2362 2.2551 H 1 UNL1111111111 0.1518 81 H 2.4983 -2.6544 2.5722 H 1 UNL1111111111 0.1507 82 H 0.8380 -2.7567 1.9837 H 1 UNL1111111111 0.1567 @BOND 1 1 2 1 2 1 3 1 3 1 33 1 4 2 3 1 5 2 5 1 6 2 6 1 7 3 4 1 8 3 32 1 9 4 7 1 10 4 34 1 11 4 35 1 12 5 36 1 13 5 37 1 14 5 38 1 15 6 39 1 16 6 40 1 17 6 41 1 18 7 8 1 19 7 42 1 20 7 43 1 21 8 9 1 22 8 10 2 23 9 44 1 24 9 45 1 25 9 46 1 26 10 11 1 27 10 47 1 28 11 12 1 29 11 48 1 30 11 49 1 31 12 13 1 32 12 50 1 33 12 51 1 34 13 14 2 35 13 15 1 36 14 16 1 37 14 52 1 38 15 53 1 39 15 54 1 40 15 55 1 41 16 17 1 42 16 56 1 43 16 57 1 44 17 18 1 45 17 58 1 46 17 59 1 47 18 19 2 48 18 60 1 49 19 20 1 50 19 25 1 51 20 21 1 52 20 61 1 53 20 62 1 54 21 22 1 55 21 63 1 56 21 64 1 57 22 23 2 58 22 65 1 59 23 24 1 60 23 27 1 61 24 26 1 62 24 66 1 63 24 67 1 64 25 68 1 65 25 69 1 66 25 70 1 67 26 28 1 68 26 71 1 69 26 72 1 70 27 73 1 71 27 74 1 72 27 75 1 73 28 29 2 74 28 76 1 75 29 30 1 76 29 31 1 77 30 77 1 78 30 78 1 79 30 79 1 80 31 80 1 81 31 81 1 82 31 82 1