J0E Converted by convert_cif2sdf.py 2024/03/29 11:09:15 49 52 0 0 0 0 0 0 0 0999 V2000 -0.7092 0.4985 -0.2176 N 0 0 0 0 0 2.7579 -0.8174 0.1580 N 0 0 0 0 0 0.7247 0.3677 -0.4892 C 0 0 0 0 0 -0.9639 2.9278 0.2408 N 0 0 0 0 0 2.4300 -0.2904 -2.2016 C 0 0 0 0 0 3.0719 -1.2620 -1.2067 C 0 0 0 0 0 5.1763 -0.8570 0.6732 C 0 0 0 0 0 -2.8309 -0.0962 0.0455 C 0 0 0 0 0 -4.0787 -0.8936 0.1200 C 0 0 0 0 0 -5.2480 -0.4182 -0.4703 C 0 0 0 0 0 -6.4068 -1.1628 -0.3984 C 0 0 0 0 0 -6.4092 -2.3842 0.2616 C 0 0 0 0 0 -5.2459 -2.8608 0.8508 C 0 0 0 0 0 -4.0828 -2.1240 0.7776 C 0 0 0 0 0 -1.8358 3.8629 0.5513 C 0 0 0 0 0 -4.9435 2.1164 0.7982 N 0 0 0 0 0 -3.5995 2.3754 0.6092 C 0 0 0 0 0 3.4664 -0.2530 2.1832 O 0 0 0 0 0 -2.7084 1.3429 0.2740 C 0 0 0 0 0 1.3510 -0.5972 0.5228 C 0 0 0 0 0 -1.3488 1.6613 0.0916 C 0 0 0 0 0 0.9294 -0.1784 -1.9037 C 0 0 0 0 0 3.7394 -0.6208 1.0602 C 0 0 0 0 0 6.0821 -0.5630 1.8705 C 0 0 0 0 0 -1.6342 -0.5504 -0.2427 N 0 0 0 0 0 -3.1198 3.6087 0.7314 N 0 0 0 0 0 -7.5537 -3.1123 0.3354 O 0 0 0 0 0 1.2051 1.3431 -0.4025 H 0 0 0 0 0 2.8940 0.6909 -2.1029 H 0 0 0 0 0 2.5753 -0.6616 -3.2165 H 0 0 0 0 0 4.1534 -1.2689 -1.3483 H 0 0 0 0 0 2.6747 -2.2642 -1.3653 H 0 0 0 0 0 5.3044 -1.8952 0.3667 H 0 0 0 0 0 5.4429 -0.1981 -0.1539 H 0 0 0 0 0 -5.2473 0.5319 -0.9832 H 0 0 0 0 0 -7.3138 -0.7954 -0.8552 H 0 0 0 0 0 -5.2506 -3.8111 1.3636 H 0 0 0 0 0 -3.1777 -2.4946 1.2362 H 0 0 0 0 0 -1.4874 4.8790 0.6637 H 0 0 0 0 0 -5.5829 2.8461 0.7945 H 0 0 0 0 0 -5.2480 1.2053 0.9349 H 0 0 0 0 0 0.8154 -1.5463 0.5014 H 0 0 0 0 0 1.2956 -0.1656 1.5224 H 0 0 0 0 0 0.4732 -1.1652 -1.9815 H 0 0 0 0 0 0.4630 0.4937 -2.6239 H 0 0 0 0 0 5.9539 0.4753 2.1771 H 0 0 0 0 0 5.8154 -1.2208 2.6977 H 0 0 0 0 0 7.1213 -0.7333 1.5905 H 0 0 0 0 0 -8.0977 -2.9118 1.1093 H 0 0 0 0 0 27 12 1 0 0 0 12 13 2 0 0 0 12 11 1 0 0 0 13 14 1 0 0 0 11 10 2 0 0 0 14 9 2 0 0 0 10 9 1 0 0 0 9 8 1 0 0 0 24 7 1 0 0 0 8 25 2 0 0 0 8 19 1 0 0 0 25 1 1 0 0 0 20 2 1 0 0 0 20 3 1 0 0 0 6 2 1 0 0 0 6 5 1 0 0 0 7 23 1 0 0 0 2 23 1 0 0 0 23 18 2 0 0 0 16 17 1 0 0 0 19 17 2 0 0 0 19 21 1 0 0 0 1 3 1 0 0 0 1 21 1 0 0 0 3 22 1 0 0 0 22 5 1 0 0 0 17 26 1 0 0 0 21 4 2 0 0 0 26 15 2 0 0 0 4 15 1 0 0 0 3 28 1 0 0 0 5 29 1 0 0 0 5 30 1 0 0 0 6 31 1 0 0 0 6 32 1 0 0 0 7 33 1 0 0 0 7 34 1 0 0 0 10 35 1 0 0 0 11 36 1 0 0 0 13 37 1 0 0 0 14 38 1 0 0 0 15 39 1 0 0 0 16 40 1 0 0 0 16 41 1 0 0 0 20 42 1 0 0 0 20 43 1 0 0 0 22 44 1 0 0 0 22 45 1 0 0 0 24 46 1 0 0 0 24 47 1 0 0 0 24 48 1 0 0 0 27 49 1 0 0 0 M END $$$$