B8R2JO -OEChem-04012115472D 38 40 0 0 0 0 0 0 0999 V2000 13.3243 -1.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 1.2052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.2673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 -0.3020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2915 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2982 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 0.2119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 1.2535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 1.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -0.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 0.2052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2414 2.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7924 1.5656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3972 1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 0.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1893 -1.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4665 -0.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2608 0.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4637 0.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9952 0.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -2.3873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7344 -0.9182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6879 0.2309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -0.6169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3121 -0.8406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8613 -1.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 38 1 0 0 0 0 2 22 2 0 0 0 0 3 8 1 0 0 0 0 3 10 2 0 0 0 0 4 10 1 0 0 0 0 4 12 2 0 0 0 0 5 9 2 0 0 0 0 5 15 1 0 0 0 0 6 12 1 0 0 0 0 6 22 1 0 0 0 0 6 29 1 0 0 0 0 7 20 1 0 0 0 0 7 22 1 0 0 0 0 7 34 1 0 0 0 0 8 11 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 17 19 2 0 0 0 0 17 28 1 0 0 0 0 18 21 2 0 0 0 0 18 32 1 0 0 0 0 19 21 1 0 0 0 0 19 33 1 0 0 0 0 20 23 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$