9CT Converted by convert_cif2sdf.py 2024/03/29 11:09:15 57 59 0 0 0 0 0 0 0 0999 V2000 5.3173 -4.3191 -0.9817 C 0 0 0 0 0 4.4180 -3.2331 -0.3878 C 0 0 0 0 0 5.1723 -1.9292 -0.3364 C 0 0 0 0 0 6.6835 0.3008 0.4730 C 0 0 0 0 0 3.1905 1.6620 0.1205 C 0 0 0 0 0 1.1977 2.9229 -0.1557 C 0 0 0 0 0 -0.9480 2.3662 -0.3937 C 0 0 0 0 0 -2.2037 1.5414 -0.5167 C 0 0 0 0 0 -3.2156 1.9926 0.5394 C 0 0 0 0 0 -4.4704 1.1689 0.4163 C 0 0 0 0 0 -4.5970 -0.0072 1.1314 C 0 0 0 0 0 -5.7516 -0.7676 1.0195 C 0 0 0 0 0 -7.0910 -2.6565 1.5579 C 0 0 0 0 0 -6.7806 -0.3469 0.1903 C 0 0 0 0 0 -6.6519 0.8332 -0.5259 C 0 0 0 0 0 -8.8194 0.4187 -1.4100 C 0 0 0 0 0 -5.4963 1.5928 -0.4070 C 0 0 0 0 0 6.3161 -1.8739 -0.7367 O 0 0 0 0 0 4.5756 -0.8238 0.1536 N 0 0 0 0 0 5.3060 0.3522 0.3073 C 0 0 0 0 0 4.6540 1.5938 0.2967 C 0 0 0 0 0 5.3974 2.7659 0.4525 C 0 0 0 0 0 6.7648 2.6953 0.6160 C 0 0 0 0 0 7.4059 1.4668 0.6261 C 0 0 0 0 0 2.5357 0.6393 0.0756 O 0 0 0 0 0 2.5801 2.8585 0.0105 N 0 0 0 0 0 0.4561 4.0540 -0.2797 N 0 0 0 0 0 -0.8840 3.6728 -0.4272 N 0 0 0 0 0 -5.8753 -1.9242 1.7218 O 0 0 0 0 0 -7.6578 1.2484 -1.3399 O 0 0 0 0 0 0.3457 1.8644 -0.2286 C 0 0 0 0 0 5.6156 -4.0317 -1.9900 H 0 0 0 0 0 6.2051 -4.4357 -0.3605 H 0 0 0 0 0 4.7717 -5.2615 -1.0183 H 0 0 0 0 0 3.5302 -3.1156 -1.0092 H 0 0 0 0 0 4.1197 -3.5195 0.6214 H 0 0 0 0 0 7.1900 -0.6532 0.4866 H 0 0 0 0 0 -2.6306 1.6764 -1.5095 H 0 0 0 0 0 -1.9639 0.4894 -0.3632 H 0 0 0 0 0 -2.7877 1.8577 1.5332 H 0 0 0 0 0 -3.4544 3.0457 0.3869 H 0 0 0 0 0 -3.7955 -0.3338 1.7774 H 0 0 0 0 0 -7.0595 -3.5557 2.1733 H 0 0 0 0 0 -7.9330 -2.0364 1.8661 H 0 0 0 0 0 -7.2098 -2.9355 0.5116 H 0 0 0 0 0 -7.6798 -0.9376 0.1018 H 0 0 0 0 0 -8.5382 -0.5701 -1.7726 H 0 0 0 0 0 -9.2624 0.3300 -0.4182 H 0 0 0 0 0 -9.5429 0.8638 -2.0930 H 0 0 0 0 0 -5.3956 2.5131 -0.9636 H 0 0 0 0 0 3.6373 -0.8476 0.3978 H 0 0 0 0 0 4.9029 3.7251 0.4457 H 0 0 0 0 0 7.3387 3.6020 0.7369 H 0 0 0 0 0 8.4772 1.4223 0.7555 H 0 0 0 0 0 3.1036 3.6748 0.0472 H 0 0 0 0 0 0.7927 4.9627 -0.2682 H 0 0 0 0 0 0.6203 0.8217 -0.1647 H 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 18 3 2 0 0 0 3 19 1 0 0 0 19 20 1 0 0 0 4 20 2 0 0 0 4 24 1 0 0 0 20 21 1 0 0 0 24 23 2 0 0 0 16 30 1 0 0 0 25 5 2 0 0 0 21 5 1 0 0 0 21 22 2 0 0 0 30 15 1 0 0 0 5 26 1 0 0 0 23 22 1 0 0 0 17 15 2 0 0 0 17 10 1 0 0 0 15 14 1 0 0 0 9 10 1 0 0 0 9 8 1 0 0 0 10 11 2 0 0 0 26 6 1 0 0 0 31 6 2 0 0 0 31 7 1 0 0 0 14 12 2 0 0 0 6 27 1 0 0 0 11 12 1 0 0 0 7 8 1 0 0 0 7 28 2 0 0 0 12 29 1 0 0 0 27 28 1 0 0 0 13 29 1 0 0 0 1 32 1 0 0 0 1 33 1 0 0 0 1 34 1 0 0 0 2 35 1 0 0 0 2 36 1 0 0 0 4 37 1 0 0 0 8 38 1 0 0 0 8 39 1 0 0 0 9 40 1 0 0 0 9 41 1 0 0 0 11 42 1 0 0 0 13 43 1 0 0 0 13 44 1 0 0 0 13 45 1 0 0 0 14 46 1 0 0 0 16 47 1 0 0 0 16 48 1 0 0 0 16 49 1 0 0 0 17 50 1 0 0 0 19 51 1 0 0 0 22 52 1 0 0 0 23 53 1 0 0 0 24 54 1 0 0 0 26 55 1 0 0 0 27 56 1 0 0 0 31 57 1 0 0 0 M END $$$$