C7J Converted by convert_cif2sdf.py 2024/03/29 11:09:15 75 78 0 0 0 0 0 0 0 0999 V2000 -5.6712 0.4705 1.1458 C 0 0 0 0 0 -5.2036 1.8552 0.6583 C 0 0 0 0 0 -6.4227 2.5778 -0.4558 CL 0 0 0 0 0 -5.0900 2.6917 1.9520 C 0 0 0 0 0 -4.8602 1.7248 2.9959 O 0 0 0 0 0 -5.7143 0.6010 2.6945 C 0 0 0 0 0 -5.1106 -0.5827 3.2339 O 0 0 0 0 0 -4.7167 -1.4660 2.1728 C 0 0 0 0 0 -4.5282 -0.5537 0.9343 C 0 0 0 0 0 -3.2312 0.0982 0.9568 O 0 0 0 0 0 -2.2547 -0.4588 0.2152 C 0 0 0 0 0 -2.4800 -1.4607 -0.4328 O 0 0 0 0 0 -1.0266 0.0969 0.1923 N 0 0 0 0 0 0.0357 -0.5088 -0.6143 C 0 0 0 0 0 -0.0625 0.0032 -2.0527 C 0 0 0 0 0 -1.3515 -0.4753 -2.6686 C 0 0 0 0 0 -2.4955 0.2943 -2.5627 C 0 0 0 0 0 -3.6778 -0.1434 -3.1279 C 0 0 0 0 0 -3.7170 -1.3517 -3.8001 C 0 0 0 0 0 -2.5740 -2.1203 -3.9068 C 0 0 0 0 0 -1.3901 -1.6799 -3.3454 C 0 0 0 0 0 1.3981 -0.1301 -0.0303 C 0 0 0 0 0 1.5916 1.2813 -0.1474 O 0 0 0 0 0 2.5033 -0.8611 -0.7953 C 0 0 0 0 0 3.7945 -0.6056 -0.1530 N 0 0 0 0 0 4.0612 -1.1325 1.1878 C 0 0 0 0 0 4.5664 -2.5728 1.0784 C 0 0 0 0 0 5.9173 -2.5874 0.3614 C 0 0 0 0 0 4.7267 -3.1647 2.4804 C 0 0 0 0 0 4.9512 0.2779 -0.9408 S 0 0 0 0 0 6.1742 0.0379 -0.2587 O 0 0 0 0 0 4.7732 0.0250 -2.3278 O 0 0 0 0 0 4.5678 1.9795 -0.6921 C 0 0 0 0 0 4.9814 2.6174 0.4628 C 0 0 0 0 0 4.6828 3.9510 0.6612 C 0 0 0 0 0 3.9662 4.6515 -0.3004 C 0 0 0 0 0 3.6624 6.0005 -0.1035 N 0 0 0 0 0 3.5524 4.0071 -1.4593 C 0 0 0 0 0 3.8592 2.6749 -1.6541 C 0 0 0 0 0 -6.6232 0.1634 0.7113 H 0 0 0 0 0 -4.2342 1.7787 0.1649 H 0 0 0 0 0 -6.7296 0.7538 3.0594 H 0 0 0 0 0 -4.6689 -1.1139 0.0097 H 0 0 0 0 0 -4.2510 3.3840 1.8832 H 0 0 0 0 0 -6.0177 3.2352 2.1340 H 0 0 0 0 0 -3.7791 -1.9619 2.4235 H 0 0 0 0 0 -5.4969 -2.2034 1.9846 H 0 0 0 0 0 -0.8466 0.8974 0.7102 H 0 0 0 0 0 -0.0744 -1.5926 -0.6058 H 0 0 0 0 0 -0.0412 1.0924 -2.0538 H 0 0 0 0 0 0.7802 -0.3776 -2.6324 H 0 0 0 0 0 1.4349 -0.4151 1.0209 H 0 0 0 0 0 -2.4643 1.2379 -2.0376 H 0 0 0 0 0 -0.4953 -2.2796 -3.4317 H 0 0 0 0 0 -4.5718 0.4566 -3.0446 H 0 0 0 0 0 -4.6422 -1.6944 -4.2407 H 0 0 0 0 0 -2.6042 -3.0640 -4.4309 H 0 0 0 0 0 1.6198 1.5998 -1.0608 H 0 0 0 0 0 2.2996 -1.9318 -0.7913 H 0 0 0 0 0 2.5319 -0.5017 -1.8244 H 0 0 0 0 0 4.8186 -0.5180 1.6750 H 0 0 0 0 0 3.1441 -1.1133 1.7755 H 0 0 0 0 0 3.8484 -3.1672 0.5133 H 0 0 0 0 0 6.6353 -1.9921 0.9267 H 0 0 0 0 0 6.2768 -3.6133 0.2831 H 0 0 0 0 0 5.8033 -2.1651 -0.6370 H 0 0 0 0 0 3.7639 -3.1553 2.9910 H 0 0 0 0 0 5.0862 -4.1905 2.4021 H 0 0 0 0 0 5.4447 -2.5703 3.0456 H 0 0 0 0 0 5.5391 2.0728 1.2104 H 0 0 0 0 0 3.5413 2.1740 -2.5571 H 0 0 0 0 0 5.0057 4.4490 1.5635 H 0 0 0 0 0 3.9528 6.4494 0.7060 H 0 0 0 0 0 3.1615 6.4887 -0.7763 H 0 0 0 0 0 2.9944 4.5480 -2.2095 H 0 0 0 0 0 1 2 1 0 0 0 1 6 1 0 0 0 1 9 1 0 0 0 2 3 1 0 0 0 2 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 11 13 1 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 14 22 1 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 16 21 2 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 20 21 1 0 0 0 22 23 1 0 0 0 22 24 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 25 30 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 30 31 2 0 0 0 30 32 2 0 0 0 30 33 1 0 0 0 33 34 1 0 0 0 33 39 2 0 0 0 34 35 2 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 36 38 2 0 0 0 38 39 1 0 0 0 1 40 1 0 0 0 2 41 1 0 0 0 6 42 1 0 0 0 9 43 1 0 0 0 4 44 1 0 0 0 4 45 1 0 0 0 8 46 1 0 0 0 8 47 1 0 0 0 13 48 1 0 0 0 14 49 1 0 0 0 15 50 1 0 0 0 15 51 1 0 0 0 22 52 1 0 0 0 17 53 1 0 0 0 21 54 1 0 0 0 18 55 1 0 0 0 19 56 1 0 0 0 20 57 1 0 0 0 23 58 1 0 0 0 24 59 1 0 0 0 24 60 1 0 0 0 26 61 1 0 0 0 26 62 1 0 0 0 27 63 1 0 0 0 28 64 1 0 0 0 28 65 1 0 0 0 28 66 1 0 0 0 29 67 1 0 0 0 29 68 1 0 0 0 29 69 1 0 0 0 34 70 1 0 0 0 39 71 1 0 0 0 35 72 1 0 0 0 37 73 1 0 0 0 37 74 1 0 0 0 38 75 1 0 0 0 M END $$$$