912 Converted by convert_cif2sdf.py 2026/01/30 11:05:38 61 64 0 0 0 0 0 0 0 0999 V2000 5.2263 -0.0457 -1.1332 C 0 0 0 0 0 6.0138 -1.3382 -1.3547 C 0 0 0 0 0 6.0045 -2.1683 -0.0697 C 0 0 0 0 0 6.6497 -1.3650 1.0615 C 0 0 0 0 0 6.7413 -3.3748 -0.2769 O 0 0 0 0 0 4.5614 -2.5094 0.3056 C 0 0 0 0 0 3.7729 -1.2171 0.5281 C 0 0 0 0 0 3.7822 -0.3869 -0.7569 C 0 0 0 0 0 3.0277 0.8505 -0.5445 N 0 0 0 0 0 1.6897 0.8592 -0.7018 C 0 0 0 0 0 1.1087 -0.1601 -1.0211 O 0 0 0 0 0 0.9275 2.1082 -0.4880 C 0 0 0 0 0 -0.4576 2.1197 -0.6507 C 0 0 0 0 0 1.5911 3.2788 -0.1159 C 0 0 0 0 0 0.8786 4.4428 0.0838 C 0 0 0 0 0 -0.4936 4.4561 -0.0827 C 0 0 0 0 0 -1.1657 3.2948 -0.4475 C 0 0 0 0 0 -2.5542 3.3121 -0.6101 N 0 0 0 0 0 -3.2837 2.1547 -0.4298 C 0 0 0 0 0 -4.9542 1.9971 -0.7539 S 0 0 0 0 0 -2.7937 1.0283 0.0042 N 0 0 0 0 0 -3.6199 0.0201 0.1189 C 0 0 0 0 0 -4.9063 0.3103 -0.2464 C 0 0 0 0 0 -6.0368 -0.6163 -0.2249 C 0 0 0 0 0 -5.8772 -1.7642 0.1480 O 0 0 0 0 0 -7.2571 -0.1992 -0.6187 N 0 0 0 0 0 -8.3611 -1.0470 -0.4892 C 0 0 0 0 0 -8.3135 -2.3378 -1.0041 C 0 0 0 0 0 -6.8819 -2.8994 -1.8095 CL 0 0 0 0 0 -9.4072 -3.1721 -0.8739 C 0 0 0 0 0 -10.5471 -2.7255 -0.2312 C 0 0 0 0 0 -10.5983 -1.4428 0.2813 C 0 0 0 0 0 -9.5069 -0.6040 0.1602 C 0 0 0 0 0 -9.5607 0.7915 0.7258 C 0 0 0 0 0 5.6859 0.5268 -0.3270 H 0 0 0 0 0 5.2324 0.5464 -2.0486 H 0 0 0 0 0 5.5542 -1.9097 -2.1609 H 0 0 0 0 0 7.0427 -1.0945 -1.6224 H 0 0 0 0 0 6.0885 -0.4439 1.2191 H 0 0 0 0 0 6.6436 -1.9561 1.9769 H 0 0 0 0 0 7.6786 -1.1213 0.7929 H 0 0 0 0 0 6.7765 -3.9516 0.4985 H 0 0 0 0 0 4.1018 -3.0820 -0.4996 H 0 0 0 0 0 4.5542 -3.1006 1.2220 H 0 0 0 0 0 2.7449 -1.4597 0.7958 H 0 0 0 0 0 4.2324 -0.6446 1.3343 H 0 0 0 0 0 3.3226 -0.9584 -1.5631 H 0 0 0 0 0 3.4910 1.6641 -0.2900 H 0 0 0 0 0 -0.9770 1.2162 -0.9340 H 0 0 0 0 0 2.6630 3.2725 0.0152 H 0 0 0 0 0 1.3939 5.3469 0.3710 H 0 0 0 0 0 -1.0464 5.3696 0.0756 H 0 0 0 0 0 -3.3138 -0.9538 0.4693 H 0 0 0 0 0 -7.3692 0.6895 -0.9916 H 0 0 0 0 0 -9.3710 -4.1749 -1.2738 H 0 0 0 0 0 -11.4003 -3.3796 -0.1310 H 0 0 0 0 0 -11.4907 -1.0963 0.7813 H 0 0 0 0 0 -9.9462 1.4755 -0.0311 H 0 0 0 0 0 -10.2171 0.8061 1.5953 H 0 0 0 0 0 -8.5596 1.1030 1.0214 H 0 0 0 0 0 -3.0046 4.1372 -0.8489 H 0 0 0 0 0 1 2 1 0 0 0 1 8 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 3 5 1 0 0 0 3 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 2 0 0 0 10 12 1 0 0 0 12 13 2 0 0 0 12 14 1 0 0 0 13 17 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 19 21 2 0 0 0 20 23 1 0 0 0 21 22 1 0 0 0 22 23 2 0 0 0 23 24 1 0 0 0 24 25 2 0 0 0 24 26 1 0 0 0 26 27 1 0 0 0 27 28 2 0 0 0 27 33 1 0 0 0 28 29 1 0 0 0 28 30 1 0 0 0 30 31 2 0 0 0 31 32 1 0 0 0 32 33 2 0 0 0 33 34 1 0 0 0 1 35 1 0 0 0 1 36 1 0 0 0 2 37 1 0 0 0 2 38 1 0 0 0 4 39 1 0 0 0 4 40 1 0 0 0 4 41 1 0 0 0 5 42 1 0 0 0 6 43 1 0 0 0 6 44 1 0 0 0 7 45 1 0 0 0 7 46 1 0 0 0 8 47 1 0 0 0 9 48 1 0 0 0 13 49 1 0 0 0 14 50 1 0 0 0 15 51 1 0 0 0 16 52 1 0 0 0 22 53 1 0 0 0 26 54 1 0 0 0 30 55 1 0 0 0 31 56 1 0 0 0 32 57 1 0 0 0 34 58 1 0 0 0 34 59 1 0 0 0 34 60 1 0 0 0 18 61 1 0 0 0 M END $$$$