JSD Converted by convert_cif2sdf.py 2024/03/29 11:09:15 46 56 0 0 0 0 0 0 0 0999 V2000 13.6168 1.5089 -12.1573 RU 0 0 0 0 0 14.6211 3.4746 -12.2068 C 0 0 0 0 0 15.2865 2.6025 -13.0548 C 0 0 0 0 0 14.4102 2.2369 -14.0604 C 0 0 0 0 0 13.1942 2.8514 -13.8194 C 0 0 0 0 0 13.3328 3.6227 -12.6913 C 0 0 0 0 0 13.8154 0.5005 -10.2133 C 0 0 0 0 0 12.4974 0.8694 -10.4025 C 0 0 0 0 0 11.9979 0.2181 -11.5305 C 0 0 0 0 0 13.0266 -0.5905 -12.0265 C 0 0 0 0 0 14.1421 -0.4006 -11.2177 C 0 0 0 0 0 10.6707 0.4562 -12.1533 C 0 0 0 0 0 9.8169 1.5797 -11.5840 C 0 0 0 0 0 8.3287 1.3238 -11.7458 C 0 0 0 0 0 7.5007 2.4913 -11.2325 C 0 0 0 0 0 10.2428 -0.3408 -12.9662 O 0 0 0 0 0 8.0566 3.4787 -10.7584 O 0 0 0 0 0 6.1818 2.4439 -11.3995 N 0 0 0 0 0 5.3338 3.5396 -10.9333 C 0 0 0 0 0 3.3490 2.0611 -10.6166 N 0 0 0 0 0 3.8249 3.2931 -11.2232 C 0 0 0 0 0 3.5884 3.1633 -12.9909 S 0 0 0 0 0 2.3505 1.8952 -12.7894 C 0 0 0 0 0 2.8618 1.0933 -11.5670 C 0 0 0 0 0 0.9542 2.5108 -12.5585 C 0 0 0 0 0 2.3511 0.9601 -14.0083 C 0 0 0 0 0 1.7960 0.2705 -10.9604 C 0 0 0 0 0 1.0858 0.6717 -10.0606 O 0 0 0 0 0 1.7094 -0.9518 -11.3943 O 0 0 0 0 0 10.0414 1.6842 -10.5125 H 0 0 0 0 0 10.0716 2.5146 -12.1047 H 0 0 0 0 0 8.1073 1.1703 -12.8121 H 0 0 0 0 0 8.0588 0.4189 -11.1812 H 0 0 0 0 0 5.7672 1.6520 -11.8481 H 0 0 0 0 0 5.4699 3.6526 -9.8478 H 0 0 0 0 0 5.6436 4.4654 -11.4405 H 0 0 0 0 0 4.1037 1.6492 -10.1065 H 0 0 0 0 0 3.2361 4.1567 -10.8815 H 0 0 0 0 0 3.6858 0.4426 -11.8955 H 0 0 0 0 0 0.2136 1.7065 -12.4381 H 0 0 0 0 0 0.9724 3.1313 -11.6498 H 0 0 0 0 0 0.6808 3.1343 -13.4228 H 0 0 0 0 0 1.5850 0.1824 -13.8749 H 0 0 0 0 0 2.1291 1.5411 -14.9159 H 0 0 0 0 0 3.3392 0.4875 -14.1075 H 0 0 0 0 0 1.0393 -1.4151 -10.9049 H 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 0 0 0 1 6 1 0 0 0 1 7 1 0 0 0 1 8 1 0 0 0 1 9 1 0 0 0 1 10 1 0 0 0 1 11 1 0 0 0 2 3 1 0 0 0 2 6 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 7 8 1 0 0 0 7 11 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 9 12 1 0 0 0 10 11 1 0 0 0 12 13 1 0 0 0 12 16 2 0 0 0 13 14 1 0 0 0 14 15 1 0 0 0 15 17 2 0 0 0 15 18 1 0 0 0 18 19 1 0 0 0 19 21 1 0 0 0 20 21 1 0 0 0 20 24 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 23 25 1 0 0 0 23 26 1 0 0 0 24 27 1 0 0 0 27 28 2 0 0 0 27 29 1 0 0 0 13 30 1 0 0 0 13 31 1 0 0 0 14 32 1 0 0 0 14 33 1 0 0 0 18 34 1 0 0 0 19 35 1 0 0 0 19 36 1 0 0 0 20 37 1 0 0 0 21 38 1 0 0 0 24 39 1 0 0 0 25 40 1 0 0 0 25 41 1 0 0 0 25 42 1 0 0 0 26 43 1 0 0 0 26 44 1 0 0 0 26 45 1 0 0 0 29 46 1 0 0 0 M END $$$$