CS5 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 83 85 0 0 0 0 0 0 0 0999 V2000 3.9825 1.6631 1.3559 C 0 0 0 0 0 2.7563 2.0118 1.8850 C 0 0 0 0 0 1.6139 1.3429 1.4944 C 0 0 0 0 0 1.6920 0.3069 0.5604 C 0 0 0 0 0 2.9259 -0.0507 0.0229 C 0 0 0 0 0 4.0758 0.6292 0.4212 C 0 0 0 0 0 5.3899 0.2582 -0.1447 C 0 0 0 0 0 6.2359 1.2161 -0.5710 N 0 0 0 0 0 5.7076 -0.9131 -0.2257 O 0 0 0 0 0 7.4810 0.8470 -1.2489 C 0 0 0 0 0 7.2327 0.7536 -2.7557 C 0 0 0 0 0 8.5338 0.3675 -3.4634 C 0 0 0 0 0 5.9101 2.6290 -0.3560 C 0 0 0 0 0 6.6443 3.1387 0.8857 C 0 0 0 0 0 6.2010 4.5712 1.1880 C 0 0 0 0 0 0.4672 -0.4102 0.1451 C 0 0 0 0 0 -0.7259 -0.0640 0.6661 N 0 0 0 0 0 0.5371 -1.3115 -0.6676 O 0 0 0 0 0 -1.9394 -0.7736 0.2537 C 0 0 0 0 0 -3.1545 0.1333 0.4548 C 0 0 0 0 0 -2.1021 -2.0388 1.0989 C 0 0 0 0 0 -3.3265 0.3979 1.8486 O 0 0 0 0 0 -4.4053 -0.5594 -0.0905 C 0 0 0 0 0 -5.5494 0.3575 -0.0073 N 0 0 0 0 0 -6.7703 -0.2754 -0.5229 C 0 0 0 0 0 -7.9198 0.6928 -0.4214 C 0 0 0 0 0 -0.9672 -2.9872 0.8078 C 0 0 0 0 0 -1.0890 -3.9192 -0.2044 C 0 0 0 0 0 -0.0463 -4.7906 -0.4727 C 0 0 0 0 0 1.1174 -4.7277 0.2742 C 0 0 0 0 0 1.2384 -3.7926 1.2872 C 0 0 0 0 0 0.1969 -2.9186 1.5503 C 0 0 0 0 0 -8.6941 0.7292 0.7244 C 0 0 0 0 0 -9.7492 1.6161 0.8203 C 0 0 0 0 0 -10.0338 2.4699 -0.2288 C 0 0 0 0 0 -9.2592 2.4354 -1.3787 C 0 0 0 0 0 -8.1972 1.5482 -1.4704 C 0 0 0 0 0 -9.5371 3.2735 -2.4119 O 0 0 0 0 0 -10.6421 4.1649 -2.2443 C 0 0 0 0 0 2.6640 3.1285 2.8928 C 0 0 0 0 0 -0.1666 -5.7035 -1.4618 F 0 0 0 0 0 2.3735 -3.7298 2.0173 F 0 0 0 0 0 4.8723 2.1942 1.6620 H 0 0 0 0 0 0.6570 1.6203 1.9125 H 0 0 0 0 0 2.9924 -0.8510 -0.6987 H 0 0 0 0 0 8.2402 1.6026 -1.0513 H 0 0 0 0 0 7.8238 -0.1184 -0.8768 H 0 0 0 0 0 6.4735 -0.0021 -2.9532 H 0 0 0 0 0 6.8900 1.7190 -3.1278 H 0 0 0 0 0 9.2930 1.1242 -3.2659 H 0 0 0 0 0 8.8765 -0.5978 -3.0913 H 0 0 0 0 0 8.3572 0.3016 -4.5371 H 0 0 0 0 0 6.2202 3.2087 -1.2255 H 0 0 0 0 0 4.8352 2.7360 -0.2127 H 0 0 0 0 0 6.4092 2.4982 1.7351 H 0 0 0 0 0 7.7196 3.1212 0.7050 H 0 0 0 0 0 6.4371 5.2116 0.3376 H 0 0 0 0 0 5.1266 4.5887 1.3688 H 0 0 0 0 0 6.7247 4.9344 2.0722 H 0 0 0 0 0 -0.7823 0.6549 1.3140 H 0 0 0 0 0 -1.8606 -1.0480 -0.7983 H 0 0 0 0 0 -2.9993 1.0720 -0.0758 H 0 0 0 0 0 -2.0924 -1.7737 2.1556 H 0 0 0 0 0 -3.0487 -2.5203 0.8541 H 0 0 0 0 0 -3.4699 -0.3949 2.3843 H 0 0 0 0 0 -4.2401 -0.8406 -1.1311 H 0 0 0 0 0 -4.6115 -1.4530 0.4987 H 0 0 0 0 0 -5.6831 0.6833 0.9386 H 0 0 0 0 0 -6.6220 -0.5547 -1.5659 H 0 0 0 0 0 -6.9933 -1.1671 0.0628 H 0 0 0 0 0 -1.9969 -3.9690 -0.7864 H 0 0 0 0 0 1.9307 -5.4074 0.0658 H 0 0 0 0 0 0.2918 -2.1863 2.3385 H 0 0 0 0 0 -8.4730 0.0618 1.5443 H 0 0 0 0 0 -10.3518 1.6427 1.7164 H 0 0 0 0 0 -10.8596 3.1630 -0.1526 H 0 0 0 0 0 -7.5897 1.5225 -2.3625 H 0 0 0 0 0 -11.5527 3.5875 -2.0829 H 0 0 0 0 0 -10.4624 4.8091 -1.3846 H 0 0 0 0 0 -10.7542 4.7767 -3.1399 H 0 0 0 0 0 2.5055 4.0743 2.3750 H 0 0 0 0 0 1.8289 2.9403 3.5685 H 0 0 0 0 0 3.5902 3.1787 3.4651 H 0 0 0 0 0 1 6 1 0 0 0 1 2 2 0 0 0 1 43 1 0 0 0 2 3 1 0 0 0 2 40 1 0 0 0 3 4 2 0 0 0 3 44 1 0 0 0 4 5 1 0 0 0 4 16 1 0 0 0 5 6 2 0 0 0 5 45 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 7 9 2 0 0 0 8 10 1 0 0 0 8 13 1 0 0 0 10 11 1 0 0 0 10 46 1 0 0 0 10 47 1 0 0 0 11 12 1 0 0 0 11 48 1 0 0 0 11 49 1 0 0 0 12 50 1 0 0 0 12 51 1 0 0 0 12 52 1 0 0 0 13 14 1 0 0 0 13 53 1 0 0 0 13 54 1 0 0 0 14 15 1 0 0 0 14 55 1 0 0 0 14 56 1 0 0 0 15 57 1 0 0 0 15 58 1 0 0 0 15 59 1 0 0 0 16 17 1 0 0 0 16 18 2 0 0 0 17 19 1 0 0 0 17 60 1 0 0 0 19 21 1 0 0 0 19 20 1 0 0 0 19 61 1 0 0 0 20 22 1 0 0 0 20 23 1 0 0 0 20 62 1 0 0 0 21 27 1 0 0 0 21 63 1 0 0 0 21 64 1 0 0 0 22 65 1 0 0 0 23 24 1 0 0 0 23 66 1 0 0 0 23 67 1 0 0 0 24 25 1 0 0 0 24 68 1 0 0 0 25 26 1 0 0 0 25 69 1 0 0 0 25 70 1 0 0 0 26 37 2 0 0 0 26 33 1 0 0 0 27 32 2 0 0 0 27 28 1 0 0 0 28 29 2 0 0 0 28 71 1 0 0 0 29 30 1 0 0 0 29 41 1 0 0 0 30 31 2 0 0 0 30 72 1 0 0 0 31 42 1 0 0 0 31 32 1 0 0 0 32 73 1 0 0 0 33 34 2 0 0 0 33 74 1 0 0 0 34 35 1 0 0 0 34 75 1 0 0 0 35 36 2 0 0 0 35 76 1 0 0 0 36 38 1 0 0 0 36 37 1 0 0 0 37 77 1 0 0 0 38 39 1 0 0 0 39 78 1 0 0 0 39 79 1 0 0 0 39 80 1 0 0 0 40 81 1 0 0 0 40 82 1 0 0 0 40 83 1 0 0 0 M END $$$$