C85 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 34 36 0 0 0 0 0 0 0 0999 V2000 5.0825 -2.2348 0.9462 O 0 0 0 0 0 5.3128 -0.9673 0.3458 S 0 0 0 0 0 6.2057 -0.0019 0.8850 O 0 0 0 0 0 5.8268 -1.2684 -1.1989 N 0 0 0 0 0 3.7409 -0.1797 0.2278 C 0 0 0 0 0 2.5875 -0.9438 0.2109 C 0 0 0 0 0 1.3535 -0.3344 0.1186 C 0 0 0 0 0 1.2706 1.0581 0.0425 C 0 0 0 0 0 2.4392 1.8237 0.0600 C 0 0 0 0 0 3.6655 1.2008 0.1585 C 0 0 0 0 0 -0.0466 1.7180 -0.0571 C 0 0 0 0 0 -1.2365 1.0909 -0.0831 O 0 0 0 0 0 -0.2570 3.0656 -0.1325 C 0 0 0 0 0 -1.6385 3.2617 -0.2128 C 0 0 0 0 0 -2.2224 2.0084 -0.1800 C 0 0 0 0 0 -3.6075 1.7361 -0.2333 C 0 0 0 0 0 -4.0509 0.4467 -0.1874 C 0 0 0 0 0 -3.0786 -1.0320 -0.0611 S 0 0 0 0 0 -4.4729 -2.1254 -0.0723 C 0 0 0 0 0 -4.4421 -3.4283 -0.0009 N 0 0 0 0 0 -5.5889 -1.3368 -0.1691 N 0 0 0 0 0 -5.4348 -0.0243 -0.2245 C 0 0 0 0 0 -6.3801 0.7383 -0.3054 O 0 0 0 0 0 5.2741 -1.0108 -1.9537 H 0 0 0 0 0 6.6817 -1.7028 -1.3494 H 0 0 0 0 0 4.5702 1.7908 0.1766 H 0 0 0 0 0 2.6538 -2.0201 0.2694 H 0 0 0 0 0 2.3818 2.8997 0.0008 H 0 0 0 0 0 0.4543 -0.9324 0.1051 H 0 0 0 0 0 0.5007 3.8341 -0.1296 H 0 0 0 0 0 -2.1519 4.2099 -0.2840 H 0 0 0 0 0 -4.3151 2.5482 -0.3107 H 0 0 0 0 0 -6.4734 -1.7324 -0.1923 H 0 0 0 0 0 -5.2692 -3.9336 -0.0153 H 0 0 0 0 0 2 1 2 0 0 0 3 2 2 0 0 0 2 4 1 0 0 0 2 5 1 0 0 0 5 6 2 0 0 0 7 6 1 0 0 0 8 7 2 0 0 0 9 8 1 0 0 0 10 9 2 0 0 0 5 10 1 0 0 0 8 11 1 0 0 0 11 12 1 0 0 0 11 13 2 0 0 0 13 14 1 0 0 0 12 15 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 19 21 1 0 0 0 17 22 1 0 0 0 21 22 1 0 0 0 22 23 2 0 0 0 4 24 1 0 0 0 4 25 1 0 0 0 10 26 1 0 0 0 6 27 1 0 0 0 9 28 1 0 0 0 7 29 1 0 0 0 13 30 1 0 0 0 14 31 1 0 0 0 16 32 1 0 0 0 21 33 1 0 0 0 20 34 1 0 0 0 M END $$$$