LBN6R5 -OEChem-05022323063D 41 44 0 0 0 0 0 0 0999 V2000 -3.4372 -3.2589 -0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1227 3.1419 1.2445 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6537 -1.7938 -0.0916 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9502 0.5478 -0.0791 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6049 0.0398 0.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6377 0.7152 -0.7705 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3404 0.3369 -0.0539 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9059 -0.9453 -0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1716 -0.4906 -0.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3037 -0.3230 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1925 1.4462 -0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0751 -0.0076 -0.1618 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0021 -2.1132 -0.0701 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5017 0.1547 -0.1869 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8682 0.7939 -0.7311 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -1.2823 0.4777 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2924 -1.1218 -0.0183 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2539 0.9515 -0.7545 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5106 -1.1246 0.4542 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5782 1.2764 -0.0075 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6416 2.8363 -0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1264 -0.0052 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3493 -0.3190 0.7846 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 0.7823 -1.1186 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8348 -0.2378 1.0934 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0065 -2.5750 -0.1332 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2471 1.5508 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7194 -2.1521 0.9863 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7362 -2.1132 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6684 1.8332 -1.2372 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1208 -1.8950 0.9188 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2447 2.1349 0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8468 2.9411 -0.7892 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4150 3.5731 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2047 -0.1339 0.0227 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1802 -0.8608 1.7061 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0918 1.2855 -2.0399 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3129 0.7138 1.3387 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6156 -0.7925 2.0091 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4767 -0.8342 0.4403 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7677 4.0462 1.2017 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 21 1 0 0 0 0 2 41 1 0 0 0 0 3 9 1 0 0 0 0 3 13 1 0 0 0 0 3 26 1 0 0 0 0 4 7 1 0 0 0 0 4 9 2 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 25 1 0 0 0 0 6 24 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 13 1 0 0 0 0 8 17 2 0 0 0 0 9 10 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 14 1 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 14 23 2 0 0 0 0 14 24 1 0 0 0 0 15 18 1 0 0 0 0 15 27 1 0 0 0 0 16 19 2 0 0 0 0 16 28 1 0 0 0 0 17 22 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 22 2 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$