J94 Converted by convert_cif2sdf.py 2024/05/03 11:07:26 48 53 0 0 0 0 0 0 0 0999 V2000 2.3895 2.8737 0.0527 C 0 0 0 0 0 2.0896 1.4418 0.1760 N 0 3 0 0 0 2.2231 1.0302 1.5800 C 0 0 0 0 0 3.0245 0.6692 -0.6572 C 0 0 0 0 0 2.9025 -0.8092 -0.2830 C 0 0 0 0 0 1.4542 -1.2251 -0.3139 C 0 0 0 0 0 0.4377 -0.2935 -0.3088 C 0 0 0 0 0 -0.8836 -0.7133 -0.3349 C 0 0 0 0 0 -1.1900 -2.0621 -0.3670 C 0 0 0 0 0 -2.3851 -2.7217 -0.3964 O 0 0 0 0 0 -2.0858 -4.0755 -0.0094 C 0 0 0 0 0 -0.7142 -4.2513 -0.4088 O 0 0 0 0 0 -0.1622 -3.0031 -0.3749 C 0 0 0 0 0 1.1538 -2.5792 -0.3484 C 0 0 0 0 0 0.7204 1.1857 -0.2811 C 0 0 0 0 0 -0.2644 1.8695 0.6684 C 0 0 0 0 0 -0.4304 1.0735 1.8734 O 0 0 0 0 0 -1.7179 0.7067 1.9832 C 0 0 0 0 0 -2.1747 0.0340 2.8855 O 0 0 0 0 0 -2.4969 1.2365 0.8525 C 0 0 0 0 0 -3.8492 1.1401 0.5071 C 0 0 0 0 0 -4.8965 0.5156 1.1157 O 0 0 0 0 0 -6.0801 1.0975 0.5393 C 0 0 0 0 0 -5.6514 1.5219 -0.7678 O 0 0 0 0 0 -4.3113 1.7601 -0.6517 C 0 0 0 0 0 -3.4345 2.4695 -1.4544 C 0 0 0 0 0 -2.0936 2.5655 -1.1129 C 0 0 0 0 0 -1.6263 1.9580 0.0266 C 0 0 0 0 0 1.6902 3.4458 0.6630 H 0 0 0 0 0 3.4074 3.0622 0.3933 H 0 0 0 0 0 2.2926 3.1772 -0.9904 H 0 0 0 0 0 1.6290 1.6912 2.2099 H 0 0 0 0 0 1.8699 0.0049 1.6930 H 0 0 0 0 0 3.2707 1.0883 1.8768 H 0 0 0 0 0 2.7728 0.8023 -1.7094 H 0 0 0 0 0 3.4686 -1.4104 -0.9946 H 0 0 0 0 0 -1.6798 0.0175 -0.3280 H 0 0 0 0 0 -2.1901 -4.1981 1.0684 H 0 0 0 0 0 -2.7338 -4.7764 -0.5374 H 0 0 0 0 0 1.9528 -3.3066 -0.3531 H 0 0 0 0 0 0.5944 1.5940 -1.2843 H 0 0 0 0 0 0.0937 2.8676 0.9243 H 0 0 0 0 0 -6.8728 0.3548 0.4597 H 0 0 0 0 0 -6.4124 1.9517 1.1291 H 0 0 0 0 0 -3.7955 2.9491 -2.3523 H 0 0 0 0 0 -1.4152 3.1205 -1.7438 H 0 0 0 0 0 4.0428 1.0124 -0.4778 H 0 0 0 0 0 3.3030 -0.9633 0.7184 H 0 0 0 0 0 12 11 1 0 0 0 12 13 1 0 0 0 11 10 1 0 0 0 14 13 2 0 0 0 14 6 1 0 0 0 13 9 1 0 0 0 5 6 1 0 0 0 5 4 1 0 0 0 10 9 1 0 0 0 6 7 2 0 0 0 9 8 2 0 0 0 4 2 1 0 0 0 7 8 1 0 0 0 7 15 1 0 0 0 19 18 2 0 0 0 1 2 1 0 0 0 2 15 1 0 0 0 2 3 1 0 0 0 17 18 1 0 0 0 17 16 1 0 0 0 18 20 1 0 0 0 15 16 1 0 0 0 16 28 1 0 0 0 20 21 2 0 0 0 20 28 1 0 0 0 22 21 1 0 0 0 22 23 1 0 0 0 21 25 1 0 0 0 28 27 2 0 0 0 23 24 1 0 0 0 25 24 1 0 0 0 25 26 2 0 0 0 27 26 1 0 0 0 1 29 1 0 0 0 1 30 1 0 0 0 1 31 1 0 0 0 3 32 1 0 0 0 3 33 1 0 0 0 3 34 1 0 0 0 4 35 1 0 0 0 5 36 1 0 0 0 8 37 1 0 0 0 11 38 1 0 0 0 11 39 1 0 0 0 14 40 1 0 0 0 15 41 1 0 0 0 16 42 1 0 0 0 23 43 1 0 0 0 23 44 1 0 0 0 26 45 1 0 0 0 27 46 1 0 0 0 4 47 1 0 0 0 5 48 1 0 0 0 M END $$$$