IB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 60 65 0 0 0 0 0 0 0 0999 V2000 7.0353 1.1460 -0.3851 C 0 0 0 0 0 4.3310 0.5460 -0.2902 C 0 0 0 0 0 6.5845 0.0998 0.4114 C 0 0 0 0 0 5.2412 -0.2018 0.4610 C 0 0 0 0 0 6.1325 1.8944 -1.1302 C 0 0 0 0 0 4.7872 1.5959 -1.0898 C 0 0 0 0 0 8.3605 1.4403 -0.4306 O 0 0 0 0 0 2.8899 0.2248 -0.2405 C 0 0 0 0 0 0.6889 0.4422 -0.1715 C 0 0 0 0 0 1.0401 -0.9215 -0.1673 C 0 0 0 0 0 0.0351 -1.8954 -0.1245 C 0 0 0 0 0 -1.2748 -1.5242 -0.0871 C 0 0 0 0 0 -1.6311 -0.1691 -0.0914 C 0 0 0 0 0 -0.6432 0.8138 -0.1336 C 0 0 0 0 0 1.8781 1.1465 -0.2185 N 0 0 0 0 0 2.3866 -0.9865 -0.2158 N 0 0 0 0 0 -3.0564 0.2188 -0.0498 C 0 0 0 0 0 -5.2392 0.2497 -0.4255 C 0 0 0 0 0 -4.8860 1.2923 0.4507 C 0 0 0 0 0 -5.8784 2.1509 0.9356 C 0 0 0 0 0 -7.1779 1.9730 0.5600 C 0 0 0 0 0 -7.5314 0.9405 -0.3066 C 0 0 0 0 0 -6.5637 0.0801 -0.7999 C 0 0 0 0 0 -4.0650 -0.4148 -0.7273 N 0 0 0 0 0 -3.5463 1.2168 0.6441 N 0 0 0 0 0 -8.8673 0.7733 -0.6819 N 0 0 0 0 0 -11.5743 0.3518 0.2177 N 0 3 0 0 0 -9.6313 1.8255 -0.0028 C 0 0 0 0 0 -11.1225 1.6523 -0.2972 C 0 0 0 0 0 -10.7922 -0.7193 -0.4129 C 0 0 0 0 0 -9.3068 -0.5089 -0.1162 C 0 0 0 0 0 -12.9982 0.1688 -0.0940 C 0 0 0 0 0 6.8183 3.4704 -2.3289 I 0 0 0 0 0 9.0193 0.5127 0.4336 C 0 0 0 0 0 7.2887 -0.4769 0.9930 H 0 0 0 0 0 4.8919 -1.0140 1.0806 H 0 0 0 0 0 4.0867 2.1749 -1.6725 H 0 0 0 0 0 0.2987 -2.9430 -0.1203 H 0 0 0 0 0 -2.0461 -2.2800 -0.0531 H 0 0 0 0 0 -0.9164 1.8581 -0.1371 H 0 0 0 0 0 1.9765 2.1116 -0.2326 H 0 0 0 0 0 -5.6153 2.9549 1.6085 H 0 0 0 0 0 -7.9407 2.6389 0.9378 H 0 0 0 0 0 -6.8394 -0.7186 -1.4717 H 0 0 0 0 0 -3.9734 -1.1849 -1.3093 H 0 0 0 0 0 -11.4415 0.3214 1.2179 H 0 0 0 0 0 -9.4637 1.7599 1.0723 H 0 0 0 0 0 -9.3024 2.8012 -0.3607 H 0 0 0 0 0 -11.6839 2.4506 0.1874 H 0 0 0 0 0 -11.2867 1.6932 -1.3738 H 0 0 0 0 0 -11.1090 -1.6837 -0.0140 H 0 0 0 0 0 -10.9541 -0.7011 -1.4908 H 0 0 0 0 0 -8.7290 -1.3185 -0.5614 H 0 0 0 0 0 -9.1495 -0.5020 0.9620 H 0 0 0 0 0 -13.1406 0.2012 -1.1738 H 0 0 0 0 0 -13.3325 -0.7949 0.2883 H 0 0 0 0 0 -13.5770 0.9661 0.3727 H 0 0 0 0 0 10.0915 0.7112 0.4295 H 0 0 0 0 0 8.6339 0.6232 1.4467 H 0 0 0 0 0 8.8365 -0.5032 0.0837 H 0 0 0 0 0 1 3 2 0 0 0 1 5 1 0 0 0 1 7 1 0 0 0 2 4 2 0 0 0 2 6 1 0 0 0 2 8 1 0 0 0 3 4 1 0 0 0 3 35 1 0 0 0 4 36 1 0 0 0 5 6 2 0 0 0 5 33 1 0 0 0 6 37 1 0 0 0 7 34 1 0 0 0 8 15 1 0 0 0 8 16 2 0 0 0 9 10 2 0 0 0 9 14 1 0 0 0 9 15 1 0 0 0 10 11 1 0 0 0 10 16 1 0 0 0 11 12 2 0 0 0 11 38 1 0 0 0 12 13 1 0 0 0 12 39 1 0 0 0 13 14 2 0 0 0 13 17 1 0 0 0 14 40 1 0 0 0 15 41 1 0 0 0 17 24 1 0 0 0 17 25 2 0 0 0 18 19 2 0 0 0 18 23 1 0 0 0 18 24 1 0 0 0 19 20 1 0 0 0 19 25 1 0 0 0 20 21 2 0 0 0 20 42 1 0 0 0 21 22 1 0 0 0 21 43 1 0 0 0 22 23 2 0 0 0 22 26 1 0 0 0 23 44 1 0 0 0 24 45 1 0 0 0 26 28 1 0 0 0 26 31 1 0 0 0 27 29 1 0 0 0 27 30 1 0 0 0 27 32 1 0 0 0 27 46 1 0 0 0 28 29 1 0 0 0 28 47 1 0 0 0 28 48 1 0 0 0 29 49 1 0 0 0 29 50 1 0 0 0 30 31 1 0 0 0 30 51 1 0 0 0 30 52 1 0 0 0 31 53 1 0 0 0 31 54 1 0 0 0 32 55 1 0 0 0 32 56 1 0 0 0 32 57 1 0 0 0 34 58 1 0 0 0 34 59 1 0 0 0 34 60 1 0 0 0 M END $$$$