BE6NJ7 -OEChem-04012114113D 41 41 0 0 0 0 0 0 0999 V2000 -3.5687 0.5729 -0.7463 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8189 -1.1762 0.7209 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0259 1.4480 1.3144 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0547 1.6487 -0.9156 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9218 -0.5381 0.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1667 -1.1821 -0.9095 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0318 1.5461 0.2029 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7083 -1.4651 -0.0806 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4463 -2.3451 0.4135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8318 -1.3457 0.9445 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6702 1.2444 -0.1246 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5747 -2.4558 -0.6072 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3302 1.4765 1.3469 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8651 2.5753 -0.8475 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9151 0.3694 -0.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2404 -0.6453 -0.2215 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9219 0.8562 0.7088 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9734 -1.1286 -0.2194 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0245 -0.4579 -0.6955 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 1.0025 -0.4903 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -1.8816 -1.0152 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -0.4608 -0.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0682 -3.3500 0.6358 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8384 -1.9331 1.3515 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2084 -2.3395 1.2175 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4323 -0.9020 1.8647 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -2.8750 -1.5474 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 -3.1269 -0.2237 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4267 0.5920 1.9814 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0046 2.2242 1.7813 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 1.8453 1.4595 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6962 3.1505 -0.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9565 3.1855 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0607 2.4131 -1.9137 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0052 -0.0227 -1.2846 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8184 0.9524 -0.0485 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9482 -0.4874 0.4127 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7741 -0.6394 -1.6729 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -2.2014 -0.3655 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 2.5495 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8256 -0.9523 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 2 16 2 0 0 0 0 3 17 2 0 0 0 0 4 20 2 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 6 38 1 0 0 0 0 7 17 1 0 0 0 0 7 20 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 12 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 M END $$$$