J6T Converted by convert_cif2sdf.py 2024/03/29 11:09:15 51 53 0 0 0 0 0 0 0 0999 V2000 1.0314 -0.8156 2.0397 C 0 0 0 0 0 0.8893 0.2087 1.1056 C 0 0 0 0 0 -0.3656 0.7734 0.8848 C 0 0 0 0 0 -5.2980 1.7168 0.6279 C 0 0 0 0 0 -6.5637 2.1471 0.2795 C 0 0 0 0 0 -7.2690 1.4930 -0.7132 C 0 0 0 0 0 -6.7096 0.4070 -1.3607 C 0 0 0 0 0 -5.4438 -0.0267 -1.0168 C 0 0 0 0 0 -4.8342 -1.2110 -1.7229 C 0 0 0 0 0 -5.0901 -2.4606 -0.9202 C 0 0 0 0 0 3.3236 0.1323 0.5700 C 0 0 0 0 0 4.4165 0.5858 -0.1404 C 0 0 0 0 0 4.2677 1.5982 -1.0702 C 0 0 0 0 0 3.0250 2.1617 -1.2940 C 0 0 0 0 0 1.9249 1.7158 -0.5897 C 0 0 0 0 0 5.7737 -0.0242 0.0982 C 0 0 0 0 0 6.0757 -1.0428 -1.0027 C 0 0 0 0 0 -1.4593 0.3164 1.5907 C 0 0 0 0 0 -1.3114 -0.7007 2.5178 C 0 0 0 0 0 -0.0686 -1.2651 2.7405 C 0 0 0 0 0 2.0687 0.6969 0.3492 C 0 0 0 0 0 -2.8165 0.9262 1.3531 C 0 0 0 0 0 -3.4870 0.2068 0.3153 O 0 0 0 0 0 -4.7326 0.6317 -0.0245 C 0 0 0 0 0 -5.7035 -2.3959 0.1181 O 0 0 0 0 0 -4.6352 -3.6447 -1.3591 O 0 0 0 0 0 6.7941 1.0325 0.0810 N 0 0 0 0 0 7.3099 -1.7043 -0.7147 O 0 0 0 0 0 2.0006 -1.2594 2.2110 H 0 0 0 0 0 -0.4817 1.5676 0.1625 H 0 0 0 0 0 -4.7471 2.2287 1.4028 H 0 0 0 0 0 -7.0031 2.9954 0.7843 H 0 0 0 0 0 -8.2594 1.8304 -0.9831 H 0 0 0 0 0 -7.2625 -0.1028 -2.1364 H 0 0 0 0 0 -5.2839 -1.3153 -2.7103 H 0 0 0 0 0 -3.7603 -1.0586 -1.8269 H 0 0 0 0 0 3.4397 -0.6611 1.2934 H 0 0 0 0 0 5.1258 1.9502 -1.6240 H 0 0 0 0 0 2.9140 2.9528 -2.0218 H 0 0 0 0 0 0.9548 2.1570 -0.7645 H 0 0 0 0 0 5.7835 -0.5227 1.0673 H 0 0 0 0 0 5.2724 -1.7769 -1.0492 H 0 0 0 0 0 6.1542 -0.5294 -1.9619 H 0 0 0 0 0 -2.1703 -1.0553 3.0682 H 0 0 0 0 0 0.0405 -2.0588 3.4649 H 0 0 0 0 0 -3.4042 0.8723 2.2693 H 0 0 0 0 0 -2.7005 1.9680 1.0565 H 0 0 0 0 0 -4.8237 -4.4177 -0.8101 H 0 0 0 0 0 6.8058 1.5105 -0.8070 H 0 0 0 0 0 6.6541 1.6827 0.8397 H 0 0 0 0 0 7.5640 -2.3653 -1.3729 H 0 0 0 0 0 28 17 1 0 0 0 17 16 1 0 0 0 27 16 1 0 0 0 16 12 1 0 0 0 12 11 2 0 0 0 12 13 1 0 0 0 11 21 1 0 0 0 13 14 2 0 0 0 21 2 1 0 0 0 21 15 2 0 0 0 14 15 1 0 0 0 1 2 2 0 0 0 1 20 1 0 0 0 2 3 1 0 0 0 20 19 2 0 0 0 3 18 2 0 0 0 19 18 1 0 0 0 18 22 1 0 0 0 25 10 2 0 0 0 22 23 1 0 0 0 26 10 1 0 0 0 23 24 1 0 0 0 10 9 1 0 0 0 24 4 2 0 0 0 24 8 1 0 0 0 4 5 1 0 0 0 8 9 1 0 0 0 8 7 2 0 0 0 5 6 2 0 0 0 7 6 1 0 0 0 1 29 1 0 0 0 3 30 1 0 0 0 4 31 1 0 0 0 5 32 1 0 0 0 6 33 1 0 0 0 7 34 1 0 0 0 9 35 1 0 0 0 9 36 1 0 0 0 11 37 1 0 0 0 13 38 1 0 0 0 14 39 1 0 0 0 15 40 1 0 0 0 16 41 1 0 0 0 17 42 1 0 0 0 17 43 1 0 0 0 19 44 1 0 0 0 20 45 1 0 0 0 22 46 1 0 0 0 22 47 1 0 0 0 26 48 1 0 0 0 27 49 1 0 0 0 27 50 1 0 0 0 28 51 1 0 0 0 M END $$$$