9VU Converted by convert_cif2sdf.py 2024/03/29 11:09:15 39 42 0 0 0 0 0 0 0 0999 V2000 0.1658 -2.9739 0.3409 O 0 0 0 0 0 1.0655 -2.1622 0.2910 C 0 0 0 0 0 2.1969 -2.2683 -0.4247 N 0 0 0 0 0 3.0297 -1.1598 -0.2654 C 0 0 0 0 0 4.2757 -0.8684 -0.8186 C 0 0 0 0 0 4.9128 0.3141 -0.5046 C 0 0 0 0 0 4.3237 1.2193 0.3588 C 0 0 0 0 0 5.0256 2.5091 0.6959 C 0 0 0 0 0 3.0855 0.9375 0.9117 C 0 0 0 0 0 2.2738 2.1696 2.0940 BR 0 0 0 0 0 2.4472 -0.2425 0.6003 C 0 0 0 0 0 1.1205 -0.8345 1.0170 C 0 0 0 0 0 1.0869 -1.0358 2.4317 O 0 0 0 0 0 -0.0342 0.0666 0.5754 C 0 0 0 0 0 -1.3456 -0.5920 0.9184 C 0 0 0 0 0 -1.3557 -1.6757 1.4637 O 0 0 0 0 0 -2.6113 0.0784 0.5936 C 0 0 0 0 0 -3.8314 -0.5312 0.9125 C 0 0 0 0 0 -5.0179 0.1022 0.6053 C 0 0 0 0 0 -6.3175 -0.2674 0.8036 O 0 0 0 0 0 -7.0925 0.5714 -0.0732 C 0 0 0 0 0 -6.2878 1.7574 -0.2140 O 0 0 0 0 0 -5.0014 1.3509 -0.0222 C 0 0 0 0 0 -3.7904 1.9551 -0.3377 C 0 0 0 0 0 -2.6021 1.3311 -0.0302 C 0 0 0 0 0 2.4121 -3.0289 -0.9879 H 0 0 0 0 0 4.7425 -1.5699 -1.4930 H 0 0 0 0 0 5.8788 0.5335 -0.9359 H 0 0 0 0 0 4.7347 3.2796 -0.0184 H 0 0 0 0 0 4.7468 2.8227 1.7021 H 0 0 0 0 0 6.1049 2.3584 0.6486 H 0 0 0 0 0 0.2831 -1.4702 2.7476 H 0 0 0 0 0 0.0358 1.0261 1.0881 H 0 0 0 0 0 0.0203 0.2262 -0.5018 H 0 0 0 0 0 -3.8431 -1.4958 1.3978 H 0 0 0 0 0 -1.6635 1.8066 -0.2728 H 0 0 0 0 0 -7.2334 0.0876 -1.0392 H 0 0 0 0 0 -8.0544 0.8132 0.3790 H 0 0 0 0 0 -3.7816 2.9197 -0.8232 H 0 0 0 0 0 1 2 2 0 0 0 2 3 1 0 0 0 2 12 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 4 11 2 0 0 0 5 6 2 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 7 9 2 0 0 0 9 10 1 0 0 0 9 11 1 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 15 17 1 0 0 0 17 18 1 0 0 0 17 25 2 0 0 0 18 19 2 0 0 0 19 20 1 0 0 0 19 23 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 2 0 0 0 24 25 1 0 0 0 3 26 1 0 0 0 5 27 1 0 0 0 6 28 1 0 0 0 8 29 1 0 0 0 8 30 1 0 0 0 8 31 1 0 0 0 13 32 1 0 0 0 14 33 1 0 0 0 14 34 1 0 0 0 18 35 1 0 0 0 25 36 1 0 0 0 21 37 1 0 0 0 21 38 1 0 0 0 24 39 1 0 0 0 M END $$$$