B9EB8F -OEChem-04042102493D 38 40 0 0 0 0 0 0 0999 V2000 -2.1621 1.5281 -0.9120 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2712 1.4014 -1.8388 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9845 2.7588 -0.1654 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7053 1.1157 -1.7288 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4491 -1.4205 -1.5919 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1773 -0.6111 -0.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4711 0.8639 -0.9501 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7472 0.4619 0.5857 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0203 -0.4144 -0.9031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1769 1.7299 0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 1.9308 -0.2482 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7308 -1.8977 -0.0726 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9765 0.2732 1.4232 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7647 2.8865 1.2602 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3145 0.2061 0.2552 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1443 -2.9363 -0.7813 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0143 -2.6472 -1.5191 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7414 0.3242 1.5213 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0043 -0.9553 -0.0926 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8581 -0.7191 2.4399 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -1.9985 0.8258 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5479 -1.8805 2.0921 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6022 2.9242 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8135 0.4965 -2.5431 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6201 -2.1246 0.5086 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8047 -0.0794 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3418 1.1682 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7825 -0.4631 2.2114 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7588 2.7041 2.3399 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7837 3.0935 0.9167 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1867 3.8033 1.0953 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5584 -3.9374 -0.7557 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5122 -3.4192 -2.0929 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2012 1.2194 1.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4506 -1.0723 -1.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4114 -0.6273 3.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6558 -2.9039 0.5543 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -2.6932 2.8068 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 15 1 0 0 0 0 4 7 1 0 0 0 0 4 24 1 0 0 0 0 5 9 1 0 0 0 0 5 17 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 7 9 2 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 23 1 0 0 0 0 12 16 2 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$