9B2 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 42 45 0 0 0 0 0 0 0 0999 V2000 3.0491 -0.9577 -0.3672 C 0 0 0 0 0 4.5470 -0.7731 -0.6219 C 0 0 0 0 0 5.1128 0.2232 0.3943 C 0 0 0 0 0 4.3534 1.5468 0.2781 C 0 0 0 0 0 2.8613 1.2954 0.5062 C 0 0 0 0 0 2.3666 0.3371 -0.4902 N 0 0 0 0 0 0.9859 0.1846 -0.3942 C 0 0 0 0 0 0.1565 1.2985 -0.4868 C 0 0 0 0 0 -1.2084 1.1503 -0.3931 C 0 0 0 0 0 0.4385 -1.0820 -0.2116 C 0 0 0 0 0 -0.9262 -1.2352 -0.1167 C 0 0 0 0 0 -1.7617 -0.1183 -0.2043 C 0 0 0 0 0 -3.2251 -0.2803 -0.1030 C 0 0 0 0 0 -3.9790 0.7870 -0.1937 N 0 0 0 0 0 -5.3224 0.7133 -0.1100 C 0 0 0 0 0 -6.1237 1.8540 -0.2079 C 0 0 0 0 0 -7.4827 1.7399 -0.1175 C 0 0 0 0 0 -8.0840 0.5018 0.0696 C 0 0 0 0 0 -7.3206 -0.6410 0.1700 C 0 0 0 0 0 -5.9329 -0.5471 0.0801 C 0 0 0 0 0 -5.0671 -1.7306 0.1799 C 0 0 0 0 0 -5.5346 -2.8431 0.3449 O 0 0 0 0 0 -3.7318 -1.5387 0.0769 N 0 0 0 0 0 2.6393 -1.6549 -1.0981 H 0 0 0 0 0 2.8971 -1.3529 0.6370 H 0 0 0 0 0 5.0543 -1.7308 -0.5146 H 0 0 0 0 0 4.6994 -0.3901 -1.6307 H 0 0 0 0 0 4.9949 -0.1778 1.4014 H 0 0 0 0 0 6.1705 0.3893 0.1902 H 0 0 0 0 0 4.7233 2.2465 1.0273 H 0 0 0 0 0 4.5038 1.9663 -0.7171 H 0 0 0 0 0 2.7106 0.8890 1.5068 H 0 0 0 0 0 2.3157 2.2342 0.4100 H 0 0 0 0 0 0.5844 2.2792 -0.6324 H 0 0 0 0 0 -1.8525 2.0157 -0.4644 H 0 0 0 0 0 1.0844 -1.9446 -0.1444 H 0 0 0 0 0 -1.3511 -2.2190 0.0240 H 0 0 0 0 0 -5.6713 2.8235 -0.3533 H 0 0 0 0 0 -8.0974 2.6242 -0.1939 H 0 0 0 0 0 -9.1596 0.4342 0.1381 H 0 0 0 0 0 -7.7932 -1.6012 0.3163 H 0 0 0 0 0 -3.1293 -2.2968 0.1377 H 0 0 0 0 0 18 19 2 0 0 0 18 17 1 0 0 0 19 20 1 0 0 0 17 16 2 0 0 0 22 21 2 0 0 0 20 21 1 0 0 0 20 15 2 0 0 0 21 23 1 0 0 0 16 15 1 0 0 0 15 14 1 0 0 0 23 13 1 0 0 0 14 13 2 0 0 0 13 12 1 0 0 0 12 9 2 0 0 0 12 11 1 0 0 0 9 8 1 0 0 0 11 10 2 0 0 0 8 7 2 0 0 0 10 7 1 0 0 0 7 6 1 0 0 0 6 1 1 0 0 0 6 5 1 0 0 0 1 2 1 0 0 0 5 4 1 0 0 0 2 3 1 0 0 0 4 3 1 0 0 0 1 24 1 0 0 0 1 25 1 0 0 0 2 26 1 0 0 0 2 27 1 0 0 0 3 28 1 0 0 0 3 29 1 0 0 0 4 30 1 0 0 0 4 31 1 0 0 0 5 32 1 0 0 0 5 33 1 0 0 0 8 34 1 0 0 0 9 35 1 0 0 0 10 36 1 0 0 0 11 37 1 0 0 0 16 38 1 0 0 0 17 39 1 0 0 0 18 40 1 0 0 0 19 41 1 0 0 0 23 42 1 0 0 0 M END $$$$