C3T Converted by convert_cif2sdf.py 2024/03/29 11:09:15 77 79 0 0 0 0 0 0 0 0999 V2000 -9.1549 -1.2289 -0.6367 C 0 0 0 0 0 -8.4766 -0.2892 0.3624 C 0 0 0 0 0 -8.8556 1.1577 0.0400 C 0 0 0 0 0 -8.9370 -0.6338 1.7807 C 0 0 0 0 0 -6.9812 -0.4503 0.2673 C 0 0 0 0 0 -6.3332 -0.1924 -0.9267 C 0 0 0 0 0 -4.9613 -0.3395 -1.0132 C 0 0 0 0 0 -6.2575 -0.8483 1.3756 C 0 0 0 0 0 -4.8857 -0.9964 1.2880 C 0 0 0 0 0 -4.2375 -0.7435 0.0922 C 0 0 0 0 0 -2.7420 -0.9046 -0.0030 C 0 0 0 0 0 -2.0915 0.3618 0.3401 N 0 0 0 0 0 -0.7476 0.4563 0.3221 C 0 0 0 0 0 -0.0760 -0.5092 0.0233 O 0 0 0 0 0 -0.0802 1.7563 0.6740 C 0 0 0 0 0 1.3681 1.6893 0.5302 N 0 0 0 0 0 2.1827 0.9144 1.2675 C 0 0 0 0 0 1.6805 0.0559 1.9724 O 0 0 0 0 0 -0.5285 2.8519 -0.3511 C 0 0 0 0 0 0.5389 2.5426 -1.4533 C 0 0 0 0 0 1.7992 2.6253 -0.5269 C 0 0 0 0 0 2.9886 2.0791 -1.3092 C 0 0 0 0 0 4.2808 2.5288 -0.6297 C 0 0 0 0 0 4.1507 2.4373 0.8910 C 0 0 0 0 0 5.5120 2.7220 1.5368 C 0 0 0 0 0 5.8936 4.0729 1.2694 O 0 0 0 0 0 3.6766 1.0463 1.2958 C 0 0 0 0 0 4.2923 0.0207 0.4573 N 0 0 0 0 0 4.5311 -1.2077 0.9598 C 0 0 0 0 0 4.2333 -1.4606 2.1086 O 0 0 0 0 0 5.1653 -2.2654 0.0952 C 0 0 0 0 0 4.2772 -2.5306 -1.1220 C 0 0 0 0 0 2.9093 -3.0325 -0.6560 C 0 0 0 0 0 5.3174 -3.5045 0.8689 N 0 0 0 0 0 6.3750 -4.3525 0.3040 C 0 0 0 0 0 -8.8852 -2.2599 -0.4066 H 0 0 0 0 0 -10.2363 -1.1128 -0.5673 H 0 0 0 0 0 -8.8274 -0.9840 -1.6466 H 0 0 0 0 0 -9.9370 1.2737 0.1094 H 0 0 0 0 0 -8.3723 1.8267 0.7522 H 0 0 0 0 0 -8.5281 1.4026 -0.9699 H 0 0 0 0 0 -8.6673 -1.6638 2.0098 H 0 0 0 0 0 -8.4537 0.0362 2.4919 H 0 0 0 0 0 -10.0183 -0.5178 1.8491 H 0 0 0 0 0 -6.8988 0.1235 -1.7905 H 0 0 0 0 0 -4.4555 -0.1399 -1.9468 H 0 0 0 0 0 -6.7624 -1.0449 2.3091 H 0 0 0 0 0 -4.3192 -1.3073 2.1528 H 0 0 0 0 0 -2.4156 -1.6805 0.6909 H 0 0 0 0 0 -2.4719 -1.1895 -1.0200 H 0 0 0 0 0 -2.6286 1.1336 0.5793 H 0 0 0 0 0 -0.3648 2.0776 1.6732 H 0 0 0 0 0 -1.5239 2.6500 -0.7106 H 0 0 0 0 0 -0.3849 3.8366 0.0594 H 0 0 0 0 0 0.4254 1.5546 -1.8650 H 0 0 0 0 0 0.5656 3.3295 -2.1953 H 0 0 0 0 0 1.9456 3.6243 -0.1636 H 0 0 0 0 0 2.9375 0.9956 -1.3596 H 0 0 0 0 0 2.9621 2.4801 -2.3276 H 0 0 0 0 0 5.1127 1.9158 -0.9740 H 0 0 0 0 0 4.4825 3.5688 -0.9079 H 0 0 0 0 0 3.4333 3.1853 1.2431 H 0 0 0 0 0 5.4426 2.5708 2.6139 H 0 0 0 0 0 6.2592 2.0447 1.1234 H 0 0 0 0 0 6.7471 4.3236 1.6495 H 0 0 0 0 0 4.0082 0.8674 2.3326 H 0 0 0 0 0 4.5305 0.2228 -0.4612 H 0 0 0 0 0 6.1456 -1.9230 -0.2381 H 0 0 0 0 0 4.1519 -1.6065 -1.6879 H 0 0 0 0 0 4.7437 -3.2845 -1.7565 H 0 0 0 0 0 2.3089 -3.3088 -1.5225 H 0 0 0 0 0 3.0414 -3.9031 -0.0127 H 0 0 0 0 0 2.4028 -2.2438 -0.0991 H 0 0 0 0 0 5.4958 -3.3041 1.8417 H 0 0 0 0 0 6.5289 -5.2196 0.9468 H 0 0 0 0 0 6.0814 -4.6863 -0.6918 H 0 0 0 0 0 7.3017 -3.7811 0.2368 H 0 0 0 0 0 3 2 1 0 0 0 1 2 1 0 0 0 2 5 1 0 0 0 2 4 1 0 0 0 5 6 2 0 0 0 5 8 1 0 0 0 6 7 1 0 0 0 8 9 2 0 0 0 7 10 2 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 14 13 2 0 0 0 13 15 1 0 0 0 15 19 1 0 0 0 15 16 1 0 0 0 19 20 1 0 0 0 18 17 2 0 0 0 26 25 1 0 0 0 16 17 1 0 0 0 16 21 1 0 0 0 23 22 1 0 0 0 23 24 1 0 0 0 17 27 1 0 0 0 22 21 1 0 0 0 20 21 1 0 0 0 25 24 1 0 0 0 24 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 33 32 1 0 0 0 29 31 1 0 0 0 29 30 2 0 0 0 31 34 1 0 0 0 31 32 1 0 0 0 34 35 1 0 0 0 1 36 1 0 0 0 1 37 1 0 0 0 1 38 1 0 0 0 3 39 1 0 0 0 3 40 1 0 0 0 3 41 1 0 0 0 4 42 1 0 0 0 4 43 1 0 0 0 4 44 1 0 0 0 6 45 1 0 0 0 7 46 1 0 0 0 8 47 1 0 0 0 9 48 1 0 0 0 11 49 1 0 0 0 11 50 1 0 0 0 12 51 1 0 0 0 15 52 1 0 0 0 19 53 1 0 0 0 19 54 1 0 0 0 20 55 1 0 0 0 20 56 1 0 0 0 21 57 1 0 0 0 22 58 1 0 0 0 22 59 1 0 0 0 23 60 1 0 0 0 23 61 1 0 0 0 24 62 1 0 0 0 25 63 1 0 0 0 25 64 1 0 0 0 26 65 1 0 0 0 27 66 1 0 0 0 28 67 1 0 0 0 31 68 1 0 0 0 32 69 1 0 0 0 32 70 1 0 0 0 33 71 1 0 0 0 33 72 1 0 0 0 33 73 1 0 0 0 34 74 1 0 0 0 35 75 1 0 0 0 35 76 1 0 0 0 35 77 1 0 0 0 M END $$$$