JAN Converted by convert_cif2sdf.py 2024/03/29 11:09:15 56 60 0 0 0 0 0 0 0 0999 V2000 1.9963 1.0312 -3.4196 C 0 0 0 0 0 3.2075 1.0501 -2.5966 N 0 0 0 0 0 4.3402 1.7409 -2.8522 C 0 0 0 0 0 5.1968 1.5080 -1.8961 N 0 0 0 0 0 4.6489 0.6685 -1.0053 C 0 0 0 0 0 3.4021 0.3747 -1.4218 C 0 0 0 0 0 2.4136 -0.5304 -0.7320 C 0 0 0 0 0 3.0704 -1.1717 0.4630 C 0 0 0 0 0 3.7294 -2.3783 0.3246 C 0 0 0 0 0 4.3311 -2.9677 1.4197 C 0 0 0 0 0 4.2747 -2.3487 2.6558 C 0 0 0 0 0 5.0311 -3.0877 4.0320 CL 0 0 0 0 0 3.6159 -1.1402 2.7936 C 0 0 0 0 0 3.0187 -0.5492 1.6952 C 0 0 0 0 0 1.9710 -1.5735 -1.6667 N 0 0 0 0 0 1.2249 0.2764 -0.2795 C 0 0 0 0 0 -0.0196 -0.2874 -0.2900 C 0 0 0 0 0 -1.1216 0.4571 0.1338 C 0 0 0 0 0 1.4007 1.5867 0.1393 C 0 0 0 0 0 0.3275 2.3420 0.5580 C 0 0 0 0 0 -0.9480 1.7855 0.5593 C 0 0 0 0 0 -2.0408 2.5187 0.9738 N 0 0 0 0 0 -1.8522 3.9029 1.4156 C 0 0 0 0 0 -3.2742 1.9878 0.9791 C 0 0 0 0 0 -4.2132 2.6702 1.3522 O 0 0 0 0 0 -3.5142 0.6643 0.5643 C 0 0 0 0 0 -2.4753 -0.1211 0.1406 C 0 0 0 0 0 -2.7073 -1.5128 -0.2983 C 0 0 0 0 0 -2.0762 -2.5696 0.3584 C 0 0 0 0 0 -2.3023 -3.8686 -0.0534 C 0 0 0 0 0 -1.5238 -5.1856 0.7672 CL 0 0 0 0 0 -3.1431 -4.1216 -1.1235 C 0 0 0 0 0 -3.7670 -3.0768 -1.7822 C 0 0 0 0 0 -3.5552 -1.7758 -1.3764 C 0 0 0 0 0 2.0795 0.2470 -4.1723 H 0 0 0 0 0 1.1304 0.8381 -2.7867 H 0 0 0 0 0 1.8773 1.9969 -3.9125 H 0 0 0 0 0 4.5084 2.3791 -3.7067 H 0 0 0 0 0 5.1216 0.2973 -0.1077 H 0 0 0 0 0 3.7731 -2.8617 -0.6407 H 0 0 0 0 0 4.8454 -3.9108 1.3123 H 0 0 0 0 0 3.5714 -0.6561 3.7576 H 0 0 0 0 0 2.5042 0.3933 1.8038 H 0 0 0 0 0 1.4043 -2.2162 -1.1351 H 0 0 0 0 0 1.3573 -1.1271 -2.3308 H 0 0 0 0 0 -0.1501 -1.3063 -0.6220 H 0 0 0 0 0 2.3910 2.0194 0.1379 H 0 0 0 0 0 0.4749 3.3609 0.8830 H 0 0 0 0 0 -2.8140 4.3258 1.7054 H 0 0 0 0 0 -1.1747 3.9226 2.2707 H 0 0 0 0 0 -1.4264 4.4893 0.6025 H 0 0 0 0 0 -4.5184 0.2675 0.5815 H 0 0 0 0 0 -1.4196 -2.3731 1.1918 H 0 0 0 0 0 -3.3139 -5.1377 -1.4451 H 0 0 0 0 0 -4.4232 -3.2807 -2.6154 H 0 0 0 0 0 -4.0432 -0.9611 -1.8911 H 0 0 0 0 0 1 2 1 0 0 0 1 35 1 0 0 0 1 36 1 0 0 0 1 37 1 0 0 0 2 3 1 0 0 0 2 6 1 0 0 0 3 4 2 0 0 0 3 38 1 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 5 39 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 7 15 1 0 0 0 7 16 1 0 0 0 8 9 2 0 0 0 8 14 1 0 0 0 9 10 1 0 0 0 9 40 1 0 0 0 10 11 2 0 0 0 10 41 1 0 0 0 11 12 1 0 0 0 11 13 1 0 0 0 13 14 2 0 0 0 13 42 1 0 0 0 14 43 1 0 0 0 15 44 1 0 0 0 15 45 1 0 0 0 16 17 2 0 0 0 16 19 1 0 0 0 17 18 1 0 0 0 17 46 1 0 0 0 18 21 2 0 0 0 18 27 1 0 0 0 19 20 2 0 0 0 19 47 1 0 0 0 20 21 1 0 0 0 20 48 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 22 24 1 0 0 0 23 49 1 0 0 0 23 50 1 0 0 0 23 51 1 0 0 0 24 25 2 0 0 0 24 26 1 0 0 0 26 27 2 0 0 0 26 52 1 0 0 0 27 28 1 0 0 0 28 29 2 0 0 0 28 34 1 0 0 0 29 30 1 0 0 0 29 53 1 0 0 0 30 31 1 0 0 0 30 32 2 0 0 0 32 33 1 0 0 0 32 54 1 0 0 0 33 34 2 0 0 0 33 55 1 0 0 0 34 56 1 0 0 0 M END $$$$