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-1.9379 C.3 1 UNL111 -0.0752 21 C -4.4549 -1.5949 -1.0734 C.3 1 UNL111 -0.0186 22 C 1.7957 -1.9333 0.8511 C.3 1 UNL111 0.0505 23 C -4.7663 -0.1330 -0.6488 C.3 1 UNL111 0.1243 24 C 0.7984 2.1617 -0.5230 C.2 1 UNL111 0.5556 25 C -1.5638 1.6582 -0.0859 C.3 1 UNL111 0.0262 26 C 3.7019 2.1050 0.2604 C.3 1 UNL111 -0.2471 27 C -5.7492 0.0131 0.5154 C.3 1 UNL111 -0.3139 28 C -1.9818 2.9748 0.6273 C.3 1 UNL111 -0.0783 29 C 2.3509 -1.8943 2.2792 C.3 1 UNL111 -0.3181 30 C 1.0297 4.2777 -2.5862 C.3 1 UNL111 -0.4650 31 C 3.4461 3.6876 -2.9120 C.3 1 UNL111 -0.4481 32 C -3.7223 -1.5789 -2.4179 C.3 1 UNL111 -0.4469 33 C -5.7280 -2.4361 -1.1924 C.3 1 UNL111 -0.4538 34 C -2.7340 1.1220 -0.9030 C.2 1 UNL111 0.5973 35 C -3.5903 -2.2302 0.0028 C.2 1 UNL111 0.6070 36 C -6.1938 1.4722 0.6664 C.3 1 UNL111 -0.2474 37 C -2.7324 2.6326 1.9152 C.3 1 UNL111 -0.4625 38 C -2.8215 3.8708 -0.2830 C.3 1 UNL111 -0.4626 39 C 2.4525 -0.4935 2.7957 C.ar 1 UNL111 -0.0037 40 C -1.5175 -3.3948 0.2406 C.3 1 UNL111 0.0876 41 C -0.4933 -2.2665 0.2796 C.2 1 UNL111 0.5796 42 C -7.0740 1.6440 1.9035 C.3 1 UNL111 -0.4382 43 C -0.9469 -4.5954 -0.4939 C.3 1 UNL111 -0.4657 44 C 3.6556 -0.0335 3.3340 C.ar 1 UNL111 -0.1985 45 C 1.3440 0.3548 2.7447 C.ar 1 UNL111 -0.1528 46 C 3.7481 1.2705 3.8169 C.ar 1 UNL111 -0.1439 47 C 1.4437 1.6616 3.2153 C.ar 1 UNL111 -0.0895 48 C 2.6451 2.1198 3.7560 C.ar 1 UNL111 -0.1785 49 H 4.1720 -0.3681 0.7639 H 1 UNL111 0.1708 50 H 5.7446 0.4798 -1.4117 H 1 UNL111 0.1521 51 H 6.3891 -0.5535 -0.1261 H 1 UNL111 0.1482 52 H 6.8081 -2.0408 -1.9410 H 1 UNL111 0.1413 53 H 5.5316 -1.3327 -2.9391 H 1 UNL111 0.1517 54 H 4.1588 -3.1260 -2.2818 H 1 UNL111 0.1550 55 H 5.2976 -3.6202 -0.9915 H 1 UNL111 0.1432 56 H 1.6746 1.6128 -2.4767 H 1 UNL111 0.1920 57 H 2.5262 4.2308 -1.0200 H 1 UNL111 0.1431 58 H 1.5625 -0.9170 0.4459 H 1 UNL111 0.1822 59 H -5.0854 0.4610 -1.5351 H 1 UNL111 0.1519 60 H -1.2562 0.8985 0.6939 H 1 UNL111 0.1986 61 H 3.5284 3.1955 0.2786 H 1 UNL111 0.1633 62 H 4.7903 1.9391 0.2729 H 1 UNL111 0.1365 63 H 3.2474 1.7133 1.1949 H 1 UNL111 0.1745 64 H -5.2641 -0.3431 1.4525 H 1 UNL111 0.1833 65 H -6.6311 -0.6356 0.3711 H 1 UNL111 0.1511 66 H -0.6142 1.6491 -1.9911 H 1 UNL111 0.3351 67 H -1.0407 3.5224 0.9006 H 1 UNL111 0.1695 68 H 1.6802 -2.4911 2.9458 H 1 UNL111 0.1916 69 H 3.3251 -2.4232 2.3361 H 1 UNL111 0.1667 70 H 3.7023 4.7158 -3.1861 H 1 UNL111 0.1404 71 H 0.6918 3.7114 -3.4615 H 1 UNL111 0.1528 72 H 1.2425 5.2982 -2.9255 H 1 UNL111 0.1503 73 H 0.1893 4.3447 -1.8837 H 1 UNL111 0.1557 74 H 4.3409 3.2281 -2.4743 H 1 UNL111 0.1523 75 H 3.2250 3.1428 -3.8374 H 1 UNL111 0.1516 76 H -4.2767 -1.0165 -3.1776 H 1 UNL111 0.1552 77 H -3.5557 -2.5922 -2.8040 H 1 UNL111 0.1587 78 H -2.7271 -1.1128 -2.3352 H 1 UNL111 0.1803 79 H -6.4621 -1.9529 -1.8485 H 1 UNL111 0.1578 80 H -6.2054 -2.6094 -0.2192 H 1 UNL111 0.1585 81 H -5.5118 -3.4239 -1.6220 H 1 UNL111 0.1604 82 H -6.7405 1.8020 -0.2368 H 1 UNL111 0.1312 83 H -5.3062 2.1327 0.7421 H 1 UNL111 0.1446 84 H -2.0680 2.1703 2.6556 H 1 UNL111 0.1518 85 H -3.1622 3.5279 2.3754 H 1 UNL111 0.1440 86 H -3.8231 3.4618 -0.4579 H 1 UNL111 0.1463 87 H -2.3478 3.9989 -1.2649 H 1 UNL111 0.1556 88 H -2.9502 4.8675 0.1527 H 1 UNL111 0.1434 89 H -3.5547 1.9252 1.7380 H 1 UNL111 0.1624 90 H -1.8800 -3.6380 1.2670 H 1 UNL111 0.1730 91 H -7.3925 2.6852 2.0230 H 1 UNL111 0.1388 92 H -7.9773 1.0272 1.8440 H 1 UNL111 0.1410 93 H -6.5396 1.3569 2.8170 H 1 UNL111 0.1467 94 H 0.0581 -4.8589 -0.1164 H 1 UNL111 0.1950 95 H -0.8305 -4.3916 -1.5697 H 1 UNL111 0.1747 96 H -1.5921 -5.4749 -0.3960 H 1 UNL111 0.1565 97 H 4.5194 -0.6913 3.3877 H 1 UNL111 0.1495 98 H 0.4013 0.0036 2.3229 H 1 UNL111 0.1678 99 H 4.6830 1.6253 4.2430 H 1 UNL111 0.1398 100 H 0.5870 2.3319 3.1369 H 1 UNL111 0.1604 101 H 2.7195 3.1391 4.1247 H 1 UNL111 0.1448 @BOND 1 75 31 1 2 71 30 1 3 70 31 1 4 76 32 1 5 53 15 1 6 72 30 1 7 31 74 1 8 31 20 1 9 77 32 1 10 30 20 1 11 30 73 1 12 56 18 1 13 32 78 1 14 32 21 1 15 54 16 1 16 7 34 2 17 2 17 2 18 66 12 1 19 52 15 1 20 20 18 1 21 20 57 1 22 15 16 1 23 15 14 1 24 79 33 1 25 81 33 1 26 95 43 1 27 18 11 1 28 18 24 1 29 59 23 1 30 16 55 1 31 16 10 1 32 50 14 1 33 87 38 1 34 33 21 1 35 33 80 1 36 17 11 am 37 17 13 1 38 21 23 1 39 21 35 1 40 12 24 am 41 12 25 1 42 11 26 1 43 14 13 1 44 14 51 1 45 34 1 1 46 34 25 1 47 23 1 1 48 23 27 1 49 5 35 1 50 5 40 1 51 24 6 2 52 4 19 2 53 43 96 1 54 43 94 1 55 43 40 1 56 86 38 1 57 10 13 1 58 10 19 am 59 13 49 1 60 38 88 1 61 38 28 1 62 82 36 1 63 9 41 2 64 19 22 1 65 25 28 1 66 25 60 1 67 35 8 2 68 40 41 1 69 40 90 1 70 26 62 1 71 26 61 1 72 26 63 1 73 41 3 1 74 65 27 1 75 58 22 1 76 27 36 1 77 27 64 1 78 28 67 1 79 28 37 1 80 36 83 1 81 36 42 1 82 22 3 1 83 22 29 1 84 89 37 1 85 92 42 1 86 42 91 1 87 42 93 1 88 37 85 1 89 37 84 1 90 29 69 1 91 29 39 1 92 29 68 1 93 98 45 1 94 45 39 ar 95 45 47 ar 96 39 44 ar 97 100 47 1 98 47 48 ar 99 44 97 1 100 44 46 ar 101 48 46 ar 102 48 101 1 103 46 99 1