B8I3LR -OEChem-04012119032D 51 53 0 1 0 0 0 0 0999 V2000 4.5981 -0.7276 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 0.0730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7276 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2353 1.7202 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 1.3601 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0000 -2.2276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 2.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 1.3601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 2.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 1.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1863 1.4112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9295 2.0804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8805 1.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7216 3.0585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6237 2.4405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4647 3.7276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4158 3.4186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6381 0.7478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -2.3353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -2.3353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8385 2.4401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1672 2.9278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -3.8102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -3.8102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3566 1.6123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 0.8232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2969 2.9278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6256 2.4401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -4.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -4.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1064 2.3267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8952 0.8638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6749 1.0295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0094 1.1649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1319 3.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2133 2.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3358 4.3341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8765 3.8335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 17 2 0 0 0 0 3 7 1 0 0 0 0 3 13 1 0 0 0 0 3 16 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 4 43 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 5 44 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 25 1 0 0 0 0 7 10 1 0 0 0 0 7 17 1 0 0 0 0 7 26 1 0 0 0 0 8 11 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 12 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 15 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 15 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 47 1 0 0 0 0 21 23 2 0 0 0 0 21 48 1 0 0 0 0 22 24 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 M END $$$$