BB6J1Q -OEChem-04022107433D 39 41 0 0 0 0 0 0 0999 V2000 5.7623 0.8165 0.9481 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5256 1.0253 -0.0344 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2349 1.4074 -0.0358 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8575 -0.9961 0.0107 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -2.9953 0.0737 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -2.9026 0.0886 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5646 2.0271 -0.0681 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6936 -0.3271 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4208 -0.8697 0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5673 0.2490 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5022 2.8599 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 2.9275 1.1689 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8739 0.2529 0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3253 -2.2568 0.0617 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5793 0.2227 -1.1939 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5634 0.2856 1.2212 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6637 0.2576 0.0274 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9741 0.2252 -1.1847 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9583 0.2877 1.2305 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6397 -2.3285 0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1178 0.2594 0.0369 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8948 -0.4277 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5266 1.5007 -0.0604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5785 3.4463 -1.4092 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3461 3.5561 -1.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5433 2.2154 -2.2362 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 3.5165 1.2079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 2.3315 2.0868 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3633 3.6250 1.1705 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0565 0.1991 -2.1472 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0283 0.3079 2.1677 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4979 0.2139 -2.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4783 0.3089 2.1847 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5288 -2.9499 0.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.3792 0.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0517 -3.9132 0.1159 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0752 0.2829 -1.8912 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3502 -1.2995 -1.4534 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8512 -0.7823 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 3 10 2 0 0 0 0 4 8 2 0 0 0 0 4 20 1 0 0 0 0 5 14 1 0 0 0 0 5 20 2 0 0 0 0 6 14 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 13 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 15 18 1 0 0 0 0 15 30 1 0 0 0 0 16 19 2 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$