JDP Converted by convert_cif2sdf.py 2024/03/29 11:09:15 54 58 0 0 0 0 0 0 0 0999 V2000 5.0661 3.1130 1.2330 C 0 0 0 0 0 5.6800 3.4215 0.0335 C 0 0 0 0 0 -6.9880 1.0655 0.0112 O 0 0 0 0 0 -6.2988 2.0671 -0.0124 C 0 0 0 0 0 -4.8294 1.9508 -0.0043 C 0 0 0 0 0 -4.0327 3.0941 -0.0255 C 0 0 0 0 0 -2.6542 2.9813 -0.0179 C 0 0 0 0 0 -2.0451 1.7434 0.0107 C 0 0 0 0 0 -2.8128 0.5850 0.0323 C 0 0 0 0 0 -4.2154 0.6836 0.0308 C 0 0 0 0 0 -4.7198 -0.6872 0.0652 C 0 0 0 0 0 -3.6499 -1.5013 0.0899 C 0 0 0 0 0 -3.7078 -3.0067 0.1280 C 0 0 0 0 0 -2.4992 -0.7598 0.0620 N 0 0 0 0 0 -1.2095 -1.2811 0.0784 C 0 0 0 0 0 -0.1779 -0.4515 0.0704 N 0 0 0 0 0 1.0655 -0.9204 0.0827 C 0 0 0 0 0 2.1440 -0.0510 0.0743 N 0 0 0 0 0 1.9190 1.3968 0.0496 C 0 0 0 0 0 3.2451 2.1119 0.0440 C 0 0 0 0 0 3.8591 2.4203 -1.1554 C 0 0 0 0 0 5.0757 3.0762 -1.1607 C 0 0 0 0 0 3.8495 2.4572 1.2383 C 0 0 0 0 0 1.2681 -2.3034 0.1073 C 0 0 0 0 0 2.6704 -2.8480 0.1167 C 0 0 0 0 0 2.6617 -4.2223 0.5020 O 0 0 0 0 0 1.7402 -5.0154 -0.2570 C 0 0 0 0 0 0.3166 -4.6284 0.1479 C 0 0 0 0 0 0.1695 -3.1302 0.1169 C 0 0 0 0 0 -1.0450 -2.5942 0.1067 N 0 0 0 0 0 -6.8783 3.2838 -0.0456 N 0 0 0 0 0 5.5401 3.3786 2.1667 H 0 0 0 0 0 6.6306 3.9342 0.0290 H 0 0 0 0 0 -4.4933 4.0707 -0.0483 H 0 0 0 0 0 -2.0471 3.8747 -0.0343 H 0 0 0 0 0 -0.9674 1.6735 0.0159 H 0 0 0 0 0 -5.7564 -0.9901 0.0691 H 0 0 0 0 0 -3.7191 -3.3963 -0.8902 H 0 0 0 0 0 -2.8349 -3.3918 0.6550 H 0 0 0 0 0 -4.6135 -3.3223 0.6478 H 0 0 0 0 0 3.0491 -0.4012 0.0839 H 0 0 0 0 0 1.3587 1.6615 -0.8468 H 0 0 0 0 0 1.3508 1.6909 0.9329 H 0 0 0 0 0 3.3876 2.1486 -2.0890 H 0 0 0 0 0 5.5547 3.3181 -2.0979 H 0 0 0 0 0 3.3695 2.2153 2.1754 H 0 0 0 0 0 3.1000 -2.7548 -0.8805 H 0 0 0 0 0 3.2743 -2.2785 0.8224 H 0 0 0 0 0 1.8836 -4.8242 -1.3203 H 0 0 0 0 0 1.9091 -6.0713 -0.0487 H 0 0 0 0 0 -0.3929 -5.0769 -0.5482 H 0 0 0 0 0 0.1141 -4.9916 1.1556 H 0 0 0 0 0 -7.8454 3.3598 -0.0513 H 0 0 0 0 0 -6.3282 4.0820 -0.0649 H 0 0 0 0 0 3 4 2 0 0 0 31 4 1 0 0 0 4 5 1 0 0 0 11 10 1 0 0 0 11 12 2 0 0 0 5 10 2 0 0 0 5 6 1 0 0 0 10 9 1 0 0 0 13 12 1 0 0 0 6 7 2 0 0 0 12 14 1 0 0 0 9 14 1 0 0 0 9 8 2 0 0 0 14 15 1 0 0 0 7 8 1 0 0 0 15 30 2 0 0 0 15 16 1 0 0 0 30 29 1 0 0 0 16 17 2 0 0 0 29 28 1 0 0 0 29 24 2 0 0 0 28 27 1 0 0 0 17 24 1 0 0 0 17 18 1 0 0 0 1 2 2 0 0 0 1 23 1 0 0 0 24 25 1 0 0 0 2 22 1 0 0 0 23 20 2 0 0 0 18 19 1 0 0 0 27 26 1 0 0 0 22 21 2 0 0 0 20 21 1 0 0 0 20 19 1 0 0 0 25 26 1 0 0 0 1 32 1 0 0 0 2 33 1 0 0 0 6 34 1 0 0 0 7 35 1 0 0 0 8 36 1 0 0 0 11 37 1 0 0 0 13 38 1 0 0 0 13 39 1 0 0 0 13 40 1 0 0 0 18 41 1 0 0 0 19 42 1 0 0 0 19 43 1 0 0 0 21 44 1 0 0 0 22 45 1 0 0 0 23 46 1 0 0 0 25 47 1 0 0 0 25 48 1 0 0 0 27 49 1 0 0 0 27 50 1 0 0 0 28 51 1 0 0 0 28 52 1 0 0 0 31 53 1 0 0 0 31 54 1 0 0 0 M END $$$$