C3D Converted by convert_cif2sdf.py 2024/03/29 11:09:15 62 66 0 0 0 0 0 0 0 0999 V2000 0.5182 2.3516 1.8869 C 0 0 0 0 0 0.2517 1.0569 2.7175 C 0 0 0 0 0 -0.1602 1.3939 4.1598 C 0 0 0 0 0 -1.4477 2.2164 4.1731 C 0 0 0 0 0 -1.4721 3.3407 3.1697 C 0 0 0 0 0 -2.4588 4.3307 3.3000 C 0 0 0 0 0 -2.5594 5.3662 2.3709 C 0 0 0 0 0 -1.6827 5.4185 1.2935 C 0 0 0 0 0 -0.7041 4.4373 1.1458 C 0 0 0 0 0 -0.5850 3.3888 2.0771 C 0 0 0 0 0 1.3627 0.0241 2.5964 C 0 0 0 0 0 1.4127 -0.8126 1.4852 C 0 0 0 0 0 2.4317 -1.7589 1.3737 C 0 0 0 0 0 3.3972 -1.8657 2.3757 C 0 0 0 0 0 3.3429 -1.0252 3.4875 C 0 0 0 0 0 2.3248 -0.0789 3.5986 C 0 0 0 0 0 1.9133 2.9469 2.0823 C 0 0 0 0 0 2.9717 2.4748 1.3175 C 0 0 0 0 0 4.2447 3.0171 1.4954 C 0 0 0 0 0 4.4479 4.0258 2.4371 C 0 0 0 0 0 3.3780 4.4922 3.2009 C 0 0 0 0 0 2.1049 3.9500 3.0230 C 0 0 0 0 0 6.8019 3.6931 2.3621 C 0 0 0 0 0 7.9621 4.0975 3.2531 C 0 0 0 0 0 10.2181 3.5389 3.8994 C 0 0 0 0 0 11.3947 2.8445 3.2287 C 0 0 0 0 0 -3.5200 6.3195 2.5162 O 0 0 0 0 0 5.6908 4.5522 2.6117 O 0 0 0 0 0 9.0957 3.1940 3.0261 N 0 0 0 0 0 10.9999 2.7207 1.7605 C 0 0 0 0 0 9.6149 3.3440 1.6658 C 0 0 0 0 0 0.4937 2.0495 0.8307 H 0 0 0 0 0 -0.6161 0.5595 2.2583 H 0 0 0 0 0 0.6463 1.9539 4.6520 H 0 0 0 0 0 -0.3060 0.4783 4.7461 H 0 0 0 0 0 -1.5944 2.6168 5.1835 H 0 0 0 0 0 -2.2945 1.5536 3.9557 H 0 0 0 0 0 -3.1634 4.2983 4.1275 H 0 0 0 0 0 -1.7635 6.2230 0.5690 H 0 0 0 0 0 -0.0276 4.4927 0.2956 H 0 0 0 0 0 0.6651 -0.7375 0.7001 H 0 0 0 0 0 2.4734 -2.4135 0.5081 H 0 0 0 0 0 4.1897 -2.6025 2.2896 H 0 0 0 0 0 4.0948 -1.1082 4.2670 H 0 0 0 0 0 2.2912 0.5715 4.4688 H 0 0 0 0 0 2.8229 1.6902 0.5804 H 0 0 0 0 0 5.0744 2.6490 0.8972 H 0 0 0 0 0 3.5307 5.2775 3.9369 H 0 0 0 0 0 1.2781 4.3198 3.6225 H 0 0 0 0 0 6.4942 2.6681 2.5901 H 0 0 0 0 0 7.0662 3.7602 1.3018 H 0 0 0 0 0 8.2902 5.1203 3.0385 H 0 0 0 0 0 7.6754 4.0271 4.3065 H 0 0 0 0 0 10.0685 3.1829 4.9237 H 0 0 0 0 0 10.3934 4.6223 3.9267 H 0 0 0 0 0 11.5533 1.8475 3.6557 H 0 0 0 0 0 12.3219 3.4149 3.3530 H 0 0 0 0 0 -3.2684 7.1258 2.0363 H 0 0 0 0 0 11.7139 3.2275 1.1041 H 0 0 0 0 0 10.9717 1.6628 1.4723 H 0 0 0 0 0 9.7036 4.4006 1.3803 H 0 0 0 0 0 8.9897 2.8331 0.9269 H 0 0 0 0 0 1 17 1 0 0 0 1 10 1 0 0 0 1 2 1 0 0 0 1 32 1 0 0 0 2 3 1 0 0 0 2 11 1 0 0 0 2 33 1 0 0 0 3 4 1 0 0 0 3 34 1 0 0 0 3 35 1 0 0 0 4 5 1 0 0 0 4 36 1 0 0 0 4 37 1 0 0 0 5 6 2 0 0 0 5 10 1 0 0 0 6 7 1 0 0 0 6 38 1 0 0 0 7 27 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 8 39 1 0 0 0 9 10 2 0 0 0 9 40 1 0 0 0 11 16 1 0 0 0 11 12 2 0 0 0 12 13 1 0 0 0 12 41 1 0 0 0 13 14 2 0 0 0 13 42 1 0 0 0 14 15 1 0 0 0 14 43 1 0 0 0 15 16 2 0 0 0 15 44 1 0 0 0 16 45 1 0 0 0 17 18 2 0 0 0 17 22 1 0 0 0 18 19 1 0 0 0 18 46 1 0 0 0 19 20 2 0 0 0 19 47 1 0 0 0 20 28 1 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 21 48 1 0 0 0 22 49 1 0 0 0 23 24 1 0 0 0 23 28 1 0 0 0 23 50 1 0 0 0 23 51 1 0 0 0 24 29 1 0 0 0 24 52 1 0 0 0 24 53 1 0 0 0 25 26 1 0 0 0 25 29 1 0 0 0 25 54 1 0 0 0 25 55 1 0 0 0 26 30 1 0 0 0 26 56 1 0 0 0 26 57 1 0 0 0 27 58 1 0 0 0 29 31 1 0 0 0 30 31 1 0 0 0 30 59 1 0 0 0 30 60 1 0 0 0 31 61 1 0 0 0 31 62 1 0 0 0 M END $$$$