CBB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 55 58 0 0 0 0 0 0 0 0999 V2000 5.5901 0.4987 1.0986 C 0 0 0 0 0 4.2240 0.3463 1.1633 C 0 0 0 0 0 3.3971 1.1821 0.4163 C 0 0 0 0 0 3.9731 2.1764 -0.3972 C 0 0 0 0 0 5.3677 2.3123 -0.4451 C 0 0 0 0 0 6.1563 1.4851 0.2993 C 0 0 0 0 0 2.0331 1.2729 0.2744 N 0 0 0 0 0 1.7450 2.2988 -0.6058 C 0 0 0 0 0 2.9084 2.8603 -1.0313 C 0 0 0 0 0 1.0468 0.4234 0.9462 C 0 0 0 0 0 0.8605 -0.8478 0.1589 C 0 0 0 0 0 -0.0195 -0.8759 -0.9094 C 0 0 0 0 0 -0.1957 -2.0385 -1.6364 C 0 0 0 0 0 0.5052 -3.1792 -1.3009 C 0 0 0 0 0 1.3934 -3.1576 -0.2263 C 0 0 0 0 0 1.5711 -1.9799 0.5002 C 0 0 0 0 0 2.1478 -4.3776 0.1394 C 0 0 0 0 0 3.0598 -4.3263 1.0680 N 0 0 0 0 0 1.8870 -5.5680 -0.5041 N 0 0 0 0 0 0.3979 2.7119 -1.0201 C 0 0 0 0 0 -0.6859 2.1116 -0.4877 O 0 0 0 0 0 -1.9819 2.5097 -1.0063 C 0 0 0 0 0 -3.0692 1.8262 -0.2188 C 0 0 0 0 0 -3.6503 2.4708 0.8576 C 0 0 0 0 0 -4.6504 1.8502 1.5864 C 0 0 0 0 0 -5.0733 0.5828 1.2407 C 0 0 0 0 0 -4.4918 -0.0721 0.1556 C 0 0 0 0 0 -3.4882 0.5605 -0.5775 C 0 0 0 0 0 -4.9406 -1.4324 -0.2200 C 0 0 0 0 0 -4.3950 -2.0420 -1.2328 N 0 0 0 0 0 -5.9356 -2.0531 0.5038 N 0 0 0 0 0 0.2601 3.5965 -1.8434 O 0 0 0 0 0 6.2286 -0.1509 1.6788 H 0 0 0 0 0 3.7935 -0.4205 1.7907 H 0 0 0 0 0 5.8163 3.0729 -1.0672 H 0 0 0 0 0 7.2296 1.5918 0.2614 H 0 0 0 0 0 3.0022 3.6830 -1.7239 H 0 0 0 0 0 1.3987 0.1808 1.9485 H 0 0 0 0 0 0.0966 0.9524 1.0127 H 0 0 0 0 0 -0.5705 0.0138 -1.1752 H 0 0 0 0 0 -0.8842 -2.0542 -2.4688 H 0 0 0 0 0 0.3659 -4.0868 -1.8704 H 0 0 0 0 0 2.2604 -1.9563 1.3313 H 0 0 0 0 0 3.5540 -5.1257 1.3072 H 0 0 0 0 0 1.2075 -5.6065 -1.1955 H 0 0 0 0 0 2.3812 -6.3675 -0.2649 H 0 0 0 0 0 -2.0928 3.5905 -0.9176 H 0 0 0 0 0 -2.0570 2.2221 -2.0553 H 0 0 0 0 0 -3.3230 3.4623 1.1323 H 0 0 0 0 0 -5.0996 2.3587 2.4263 H 0 0 0 0 0 -5.8539 0.0999 1.8100 H 0 0 0 0 0 -3.0341 0.0582 -1.4186 H 0 0 0 0 0 -3.6953 -1.6046 -1.7420 H 0 0 0 0 0 -6.3417 -1.5993 1.2589 H 0 0 0 0 0 -6.2303 -2.9444 0.2579 H 0 0 0 0 0 30 29 2 0 0 0 29 31 1 0 0 0 29 27 1 0 0 0 28 27 2 0 0 0 28 23 1 0 0 0 27 26 1 0 0 0 22 23 1 0 0 0 22 21 1 0 0 0 23 24 2 0 0 0 26 25 2 0 0 0 21 20 1 0 0 0 24 25 1 0 0 0 20 32 2 0 0 0 20 8 1 0 0 0 9 8 2 0 0 0 9 4 1 0 0 0 8 7 1 0 0 0 4 5 1 0 0 0 4 3 2 0 0 0 5 6 2 0 0 0 7 3 1 0 0 0 7 10 1 0 0 0 3 2 1 0 0 0 12 13 2 0 0 0 12 11 1 0 0 0 10 11 1 0 0 0 6 1 1 0 0 0 13 14 1 0 0 0 11 16 2 0 0 0 2 1 2 0 0 0 14 15 2 0 0 0 16 15 1 0 0 0 15 17 1 0 0 0 17 18 2 0 0 0 17 19 1 0 0 0 1 33 1 0 0 0 2 34 1 0 0 0 5 35 1 0 0 0 6 36 1 0 0 0 9 37 1 0 0 0 10 38 1 0 0 0 10 39 1 0 0 0 12 40 1 0 0 0 13 41 1 0 0 0 14 42 1 0 0 0 16 43 1 0 0 0 18 44 1 0 0 0 19 45 1 0 0 0 19 46 1 0 0 0 22 47 1 0 0 0 22 48 1 0 0 0 24 49 1 0 0 0 25 50 1 0 0 0 26 51 1 0 0 0 28 52 1 0 0 0 30 53 1 0 0 0 31 54 1 0 0 0 31 55 1 0 0 0 M END $$$$