BLN4I2 -OEChem-04022105402D 42 44 0 0 0 0 0 0 0999 V2000 4.5923 0.7806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -0.6919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -0.6919 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 -0.7266 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.3081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -0.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3243 -0.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -0.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 -0.2127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 0.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 1.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 0.8289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3243 0.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1904 -0.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -0.2194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -1.3119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 -1.3119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2414 1.9627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0553 1.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7924 1.1410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3972 1.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8613 1.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 1.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4665 -1.3361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8804 -1.2289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7273 -1.0019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5004 -0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2608 0.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4637 0.2473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7344 -1.3427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6879 -0.1937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3121 -1.2652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 2 25 1 0 0 0 0 3 10 2 0 0 0 0 3 11 1 0 0 0 0 4 10 1 0 0 0 0 4 14 2 0 0 0 0 5 9 2 0 0 0 0 5 18 1 0 0 0 0 6 14 1 0 0 0 0 6 23 1 0 0 0 0 6 33 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 7 39 1 0 0 0 0 8 13 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 11 18 2 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 12 21 1 0 0 0 0 13 26 1 0 0 0 0 14 17 1 0 0 0 0 15 20 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END $$$$