B8V4XJ -OEChem-04022116073D 28 30 0 0 0 0 0 0 0999 V2000 3.6545 -2.2741 -0.8876 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4528 -1.9937 1.3132 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3622 0.5945 -1.3873 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 0.9961 0.8153 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0515 2.0422 -0.3014 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7982 0.8196 1.5557 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3279 0.0330 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3161 0.7011 -0.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9595 0.5475 0.6382 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 2.1873 0.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3224 -1.3779 0.7066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4663 0.0312 -0.7736 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2701 -0.7620 0.2979 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7044 1.6097 0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5077 -2.0975 0.1455 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4735 -1.4454 -0.5239 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3463 -1.0143 -0.5529 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7808 1.3573 -0.7063 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1017 0.0454 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6654 0.0186 2.2903 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 1.7326 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 3.1228 0.4773 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7288 -1.6079 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4636 2.6355 0.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -3.1696 0.2993 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3227 -1.9932 -0.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 2.1823 -1.0974 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9396 -0.1513 -1.7173 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 11 2 0 0 0 0 3 12 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 5 8 1 0 0 0 0 5 10 2 0 0 0 0 6 9 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 22 1 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 23 1 0 0 0 0 14 18 2 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 M END $$$$