CKY Converted by convert_cif2sdf.py 2024/03/29 11:09:15 78 82 0 0 0 0 0 0 0 0999 V2000 3.9010 -0.5366 0.6022 C 0 0 0 0 0 3.2354 3.1957 -1.6295 C 0 0 0 0 0 0.8946 3.4849 -2.0397 C 0 0 0 0 0 0.7607 2.1224 -2.2352 C 0 0 0 0 0 1.8636 1.2965 -2.1238 C 0 0 0 0 0 2.0576 -2.1981 0.3145 C 0 0 0 0 0 1.3012 -3.0323 -0.6879 C 0 0 0 0 0 -0.6370 -3.3860 -2.0644 C 0 0 0 0 0 1.8436 -4.2160 -1.1538 C 0 0 0 0 0 -0.4971 -1.4207 -0.6670 N 0 0 0 0 0 -1.8266 -1.2157 -0.7504 C 0 0 0 0 0 -2.4066 0.1244 -0.3783 C 0 0 0 0 0 2.1320 4.0210 -1.7368 C 0 0 0 0 0 -0.0885 -4.5649 -2.5314 C 0 0 0 0 0 -5.4031 -1.8591 -0.0351 C 0 0 0 0 0 -4.2035 -0.8147 1.7553 C 0 0 0 0 0 -5.2886 2.0695 -1.2616 C 0 0 0 0 0 -4.2154 2.1183 0.8790 C 0 0 0 0 0 1.1489 -4.9813 -2.0751 C 0 0 0 0 0 -5.9513 -2.7607 0.8565 C 0 0 0 0 0 -4.7465 -1.7193 2.6486 C 0 0 0 0 0 -5.8133 3.3269 -1.0283 C 0 0 0 0 0 -4.7427 3.3731 1.1170 C 0 0 0 0 0 -4.5279 -0.8882 0.4138 C 0 0 0 0 0 -4.4921 1.4648 -0.3077 C 0 0 0 0 0 0.0572 -2.6154 -1.1404 C 0 0 0 0 0 -5.6238 -2.6921 2.2000 C 0 0 0 0 0 -5.5402 3.9798 0.1619 C 0 0 0 0 0 3.1024 1.8342 -1.8263 C 0 0 0 0 0 6.6194 0.1084 1.4152 C 0 0 0 0 0 4.8208 -1.5167 1.3375 C 0 0 0 0 0 5.7725 1.1554 0.6831 C 0 0 0 0 0 5.1156 2.0879 1.7025 C 0 0 0 0 0 3.0523 -1.2960 -0.4192 C 0 0 0 0 0 -3.9251 0.0912 -0.5613 C 0 0 0 0 0 4.7341 0.4581 -0.0905 N 0 0 0 0 0 5.7394 -0.7644 2.2030 N 0 0 0 0 0 -2.5561 -2.1091 -1.1246 O 0 0 0 0 0 4.1494 -0.4472 -2.3105 O 0 0 0 0 0 5.6278 1.5575 -2.1101 O 0 0 0 0 0 -6.1603 -3.5735 3.0724 F 0 0 0 0 0 -6.0522 5.2094 0.3912 F 0 0 0 0 0 3.0526 -4.6258 -0.7100 F 0 0 0 0 0 4.5098 0.7828 -1.6984 S 0 0 0 0 0 3.2503 -0.0344 1.3180 H 0 0 0 0 0 4.2033 3.6155 -1.3971 H 0 0 0 0 0 0.0321 4.1297 -2.1268 H 0 0 0 0 0 -0.2051 1.7039 -2.4761 H 0 0 0 0 0 1.7592 0.2332 -2.2774 H 0 0 0 0 0 1.3564 -1.5835 0.8780 H 0 0 0 0 0 2.5967 -2.8536 0.9981 H 0 0 0 0 0 -1.6035 -3.0616 -2.4216 H 0 0 0 0 0 0.0749 -0.7413 -0.2789 H 0 0 0 0 0 -2.1713 0.3464 0.6628 H 0 0 0 0 0 -1.9808 0.8960 -1.0197 H 0 0 0 0 0 2.2363 5.0853 -1.5833 H 0 0 0 0 0 -0.6265 -5.1617 -3.2526 H 0 0 0 0 0 -5.6551 -1.9158 -1.0843 H 0 0 0 0 0 -3.5185 -0.0560 2.1046 H 0 0 0 0 0 -5.5044 1.5589 -2.1876 H 0 0 0 0 0 -3.5930 1.6438 1.6237 H 0 0 0 0 0 1.5733 -5.9064 -2.4383 H 0 0 0 0 0 -6.6365 -3.5196 0.5052 H 0 0 0 0 0 -4.4870 -1.6670 3.6952 H 0 0 0 0 0 -6.4348 3.8002 -1.7740 H 0 0 0 0 0 -4.5268 3.8828 2.0440 H 0 0 0 0 0 7.1689 -0.4888 0.6878 H 0 0 0 0 0 7.3240 0.6100 2.0790 H 0 0 0 0 0 4.2212 -2.1939 1.9452 H 0 0 0 0 0 5.3953 -2.0914 0.6103 H 0 0 0 0 0 6.4072 1.7349 0.0119 H 0 0 0 0 0 5.8868 2.5910 2.2858 H 0 0 0 0 0 4.5137 2.8312 1.1792 H 0 0 0 0 0 4.4772 1.5071 2.3682 H 0 0 0 0 0 2.5079 -0.5847 -1.0403 H 0 0 0 0 0 3.6999 -1.9061 -1.0487 H 0 0 0 0 0 -4.1626 -0.2171 -1.5787 H 0 0 0 0 0 5.2321 -0.2364 2.8961 H 0 0 0 0 0 42 28 1 0 0 0 28 22 2 0 0 0 28 23 1 0 0 0 22 17 1 0 0 0 23 18 2 0 0 0 17 25 2 0 0 0 18 25 1 0 0 0 25 35 1 0 0 0 20 27 2 0 0 0 20 15 1 0 0 0 41 27 1 0 0 0 27 21 1 0 0 0 15 24 2 0 0 0 21 16 2 0 0 0 24 16 1 0 0 0 24 35 1 0 0 0 13 3 2 0 0 0 13 2 1 0 0 0 3 4 1 0 0 0 35 12 1 0 0 0 2 29 2 0 0 0 12 11 1 0 0 0 4 5 2 0 0 0 39 44 2 0 0 0 29 5 1 0 0 0 29 44 1 0 0 0 11 10 1 0 0 0 11 38 2 0 0 0 44 40 2 0 0 0 44 36 1 0 0 0 31 1 1 0 0 0 31 37 1 0 0 0 10 26 1 0 0 0 1 36 1 0 0 0 1 34 1 0 0 0 36 32 1 0 0 0 6 34 1 0 0 0 6 7 1 0 0 0 37 30 1 0 0 0 30 32 1 0 0 0 26 7 2 0 0 0 26 8 1 0 0 0 32 33 1 0 0 0 7 9 1 0 0 0 8 14 2 0 0 0 9 43 1 0 0 0 9 19 2 0 0 0 14 19 1 0 0 0 1 45 1 0 0 0 2 46 1 0 0 0 3 47 1 0 0 0 4 48 1 0 0 0 5 49 1 0 0 0 6 50 1 0 0 0 6 51 1 0 0 0 8 52 1 0 0 0 10 53 1 0 0 0 12 54 1 0 0 0 12 55 1 0 0 0 13 56 1 0 0 0 14 57 1 0 0 0 15 58 1 0 0 0 16 59 1 0 0 0 17 60 1 0 0 0 18 61 1 0 0 0 19 62 1 0 0 0 20 63 1 0 0 0 21 64 1 0 0 0 22 65 1 0 0 0 23 66 1 0 0 0 30 67 1 0 0 0 30 68 1 0 0 0 31 69 1 0 0 0 31 70 1 0 0 0 32 71 1 0 0 0 33 72 1 0 0 0 33 73 1 0 0 0 33 74 1 0 0 0 34 75 1 0 0 0 34 76 1 0 0 0 35 77 1 0 0 0 37 78 1 0 0 0 M END $$$$