B1AUH6 -OEChem-04012112062D 38 40 0 0 0 0 0 0 0999 V2000 8.0658 1.0347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3339 1.0146 0.0000 O 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 5.4572 -2.5099 0.0000 N 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 -1.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7088 0.5247 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 6.3232 -1.0099 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 2.8486 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2172 -0.4753 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 7.2172 -2.5446 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 8.1232 -0.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1232 -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 3.7319 2.5246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2056 0.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3181 0.4100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9276 1.1048 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 2.3081 0.7309 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 7.2100 -3.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -0.6770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -2.3428 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 1.4667 2.8608 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 4.0357 1.9841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2724 2.8283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4282 3.0650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0586 1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 38 1 0 0 0 0 2 22 2 0 0 0 0 3 6 1 0 0 0 0 3 9 2 0 0 0 0 4 8 1 0 0 0 0 4 10 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 6 8 1 0 0 0 0 7 13 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 16 1 0 0 0 0 11 15 2 0 0 0 0 11 25 1 0 0 0 0 12 15 1 0 0 0 0 12 26 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 14 18 2 0 0 0 0 14 22 1 0 0 0 0 15 28 1 0 0 0 0 16 19 2 0 0 0 0 16 29 1 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 M END $$$$