B6I8YT -OEChem-04042106093D 40 42 0 1 0 0 0 0 0999 V2000 -4.8258 1.0742 -0.8608 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4749 0.2373 -0.4600 N 0 0 2 0 0 0 0 0 0 0 0 0 5.9893 0.2353 1.5128 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9842 -1.4657 0.3832 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1283 -3.0026 0.3849 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5321 1.4428 1.3834 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7415 0.1907 0.5233 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3155 -0.0565 -0.8755 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3997 0.9352 0.4418 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3032 -0.8016 -1.7381 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9749 -0.0537 -1.8104 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7364 0.9637 1.3866 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0953 0.4247 -0.3115 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7678 -0.6490 -0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4164 1.7115 -0.4474 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1497 -0.4461 0.1152 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7829 1.9249 -0.3045 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6346 0.8519 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3209 -1.9590 0.1167 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0596 1.1304 0.1142 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4283 -2.6884 0.5033 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5536 -0.7871 0.9908 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2337 -0.6526 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5736 0.8967 -1.3543 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9672 0.9968 1.4488 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5541 1.9622 0.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7047 -0.9385 -2.7484 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1375 -1.8023 -1.3195 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0986 0.8851 -2.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2579 -0.6695 -2.3675 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3167 1.1292 2.3854 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9387 1.9486 0.9507 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2303 2.5559 -0.6702 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6148 0.7416 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8195 -0.6698 1.9495 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1782 2.9319 -0.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7269 -2.2288 0.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1061 -3.5053 0.7191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9195 1.4852 2.1916 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5150 1.6393 1.5406 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 2 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 2 13 1 0 0 0 0 3 12 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 16 1 0 0 0 0 4 21 2 0 0 0 0 5 19 2 0 0 0 0 5 21 1 0 0 0 0 6 20 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 15 17 2 0 0 0 0 15 33 1 0 0 0 0 16 18 2 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 20 1 0 0 0 0 19 37 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$