BDB84K -OEChem-04012114402D 32 33 0 0 0 0 0 0 0999 V2000 7.1893 0.5099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7088 -0.5247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4572 0.5099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5912 1.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6972 0.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5912 2.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8486 -1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8602 -2.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4572 2.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3232 2.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7912 0.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6972 2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3232 1.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7912 2.0307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1893 2.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6298 -0.4545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 -1.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2493 -0.8285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -2.6147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4695 -1.9199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4572 -0.1101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4572 3.1299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 0.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7044 3.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 2.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6838 -2.0113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4667 -2.8608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3162 -3.0779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4993 1.9730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7262 2.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8793 3.0468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 5 1 0 0 0 0 2 7 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 5 11 2 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 15 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 11 14 1 0 0 0 0 11 24 1 0 0 0 0 12 14 2 0 0 0 0 12 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 M END $$$$