03I Converted by convert_cif2sdf.py 2024/03/29 11:09:15 68 70 0 0 0 0 0 0 0 0999 V2000 -0.8385 0.6642 0.1969 C 0 0 0 0 0 -0.3312 1.8963 -0.2139 C 0 0 0 0 0 1.0245 2.0498 -0.4157 C 0 0 0 0 0 1.8839 0.9779 -0.2111 C 0 0 0 0 0 1.3816 -0.2496 0.1975 C 0 0 0 0 0 0.0269 -0.4089 0.4020 C 0 0 0 0 0 3.2186 1.1318 -0.4116 O 0 0 0 0 0 -2.2952 0.4976 0.4213 C 0 0 0 0 0 -3.1616 1.5703 0.2171 C 0 0 0 0 0 -4.5162 1.4097 0.4265 C 0 0 0 0 0 -5.0146 0.1866 0.8396 C 0 0 0 0 0 -4.1592 -0.8808 1.0441 C 0 0 0 0 0 -2.8034 -0.7331 0.8316 C 0 0 0 0 0 -6.4943 0.0181 1.0674 C 0 0 0 0 0 -7.1620 -0.4362 -0.2323 C 0 0 0 0 0 -8.6359 -0.7472 0.0332 C 0 0 0 0 0 -9.2569 -1.3365 -1.2072 C 0 0 0 0 0 -9.5064 0.7818 0.4757 S 0 0 0 0 0 -9.3627 1.7501 -1.0511 C 0 0 0 0 0 -10.8772 0.4771 0.6919 O 0 0 0 0 0 -8.7721 1.4404 1.4994 O 0 0 0 0 0 -8.7471 -1.7490 1.1842 C 0 0 0 0 0 -10.5981 -1.4097 -1.3206 N 0 0 0 0 0 -8.5492 -1.7450 -2.1036 O 0 0 0 0 0 4.0454 -0.0109 -0.1818 C 0 0 0 0 0 5.5059 0.3528 -0.4569 C 0 0 0 0 0 6.3902 -0.8708 -0.2114 C 0 0 0 0 0 -11.1806 -1.9632 -2.4863 O 0 0 0 0 0 7.7928 -0.5222 -0.4751 N 0 0 0 0 0 8.6417 -1.7224 -0.4824 C 0 0 0 0 0 10.0803 -1.3207 -0.8191 C 0 0 0 0 0 10.5307 -0.3441 0.1233 O 0 0 0 0 0 9.7268 0.8386 0.1555 C 0 0 0 0 0 8.2851 0.4583 0.5027 C 0 0 0 0 0 -0.9992 2.7298 -0.3736 H 0 0 0 0 0 1.4183 3.0033 -0.7346 H 0 0 0 0 0 2.0526 -1.0809 0.3572 H 0 0 0 0 0 -0.3629 -1.3638 0.7236 H 0 0 0 0 0 -2.7738 2.5256 -0.1054 H 0 0 0 0 0 -5.1882 2.2401 0.2686 H 0 0 0 0 0 -4.5540 -1.8330 1.3671 H 0 0 0 0 0 -2.1374 -1.5690 0.9868 H 0 0 0 0 0 -6.6599 -0.7305 1.8416 H 0 0 0 0 0 -6.9246 0.9682 1.3839 H 0 0 0 0 0 -7.0857 0.3570 -0.9765 H 0 0 0 0 0 -6.6628 -1.3320 -0.6034 H 0 0 0 0 0 -9.8375 1.2099 -1.8700 H 0 0 0 0 0 -9.8555 2.7134 -0.9178 H 0 0 0 0 0 -8.3100 1.9096 -1.2834 H 0 0 0 0 0 -8.2988 -1.3227 2.0816 H 0 0 0 0 0 -9.7973 -1.9694 1.3729 H 0 0 0 0 0 -8.2251 -2.6674 0.9179 H 0 0 0 0 0 -11.1636 -1.0834 -0.6032 H 0 0 0 0 0 3.9401 -0.3336 0.8535 H 0 0 0 0 0 3.7399 -0.8186 -0.8475 H 0 0 0 0 0 5.6112 0.6751 -1.4935 H 0 0 0 0 0 5.8104 1.1610 0.2078 H 0 0 0 0 0 6.2849 -1.1936 0.8239 H 0 0 0 0 0 6.0857 -1.6790 -0.8762 H 0 0 0 0 0 -12.1476 -1.9740 -2.4761 H 0 0 0 0 0 8.6156 -2.1920 0.5013 H 0 0 0 0 0 8.2748 -2.4240 -1.2306 H 0 0 0 0 0 10.7249 -2.1995 -0.7689 H 0 0 0 0 0 10.1158 -0.9016 -1.8245 H 0 0 0 0 0 10.1148 1.5211 0.9109 H 0 0 0 0 0 9.7519 1.3212 -0.8207 H 0 0 0 0 0 7.6573 1.3490 0.4718 H 0 0 0 0 0 8.2537 0.0236 1.5016 H 0 0 0 0 0 2 1 2 0 0 0 1 6 1 0 0 0 1 8 1 0 0 0 3 2 1 0 0 0 2 35 1 0 0 0 3 4 2 0 0 0 3 36 1 0 0 0 7 4 1 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 5 37 1 0 0 0 6 38 1 0 0 0 7 25 1 0 0 0 8 9 2 0 0 0 8 13 1 0 0 0 9 10 1 0 0 0 9 39 1 0 0 0 10 11 2 0 0 0 10 40 1 0 0 0 11 12 1 0 0 0 11 14 1 0 0 0 13 12 2 0 0 0 12 41 1 0 0 0 13 42 1 0 0 0 14 15 1 0 0 0 14 43 1 0 0 0 14 44 1 0 0 0 15 16 1 0 0 0 15 45 1 0 0 0 15 46 1 0 0 0 22 16 1 0 0 0 18 16 1 0 0 0 16 17 1 0 0 0 17 24 2 0 0 0 17 23 1 0 0 0 21 18 2 0 0 0 18 19 1 0 0 0 18 20 2 0 0 0 19 47 1 0 0 0 19 48 1 0 0 0 19 49 1 0 0 0 22 50 1 0 0 0 22 51 1 0 0 0 22 52 1 0 0 0 23 28 1 0 0 0 23 53 1 0 0 0 26 25 1 0 0 0 25 54 1 0 0 0 25 55 1 0 0 0 26 27 1 0 0 0 26 56 1 0 0 0 26 57 1 0 0 0 29 27 1 0 0 0 27 58 1 0 0 0 27 59 1 0 0 0 28 60 1 0 0 0 30 29 1 0 0 0 34 29 1 0 0 0 31 30 1 0 0 0 30 61 1 0 0 0 30 62 1 0 0 0 32 31 1 0 0 0 31 63 1 0 0 0 31 64 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 33 65 1 0 0 0 33 66 1 0 0 0 34 67 1 0 0 0 34 68 1 0 0 0 M END $$$$