B7Q2GS -OEChem-04022108562D 46 49 0 1 0 0 0 0 0999 V2000 14.9019 2.5960 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 8.8397 -0.9040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8397 2.0960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7679 2.0960 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 14.9019 3.5960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0358 2.0960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4807 -2.9297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7057 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5717 1.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9736 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8397 1.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9736 -0.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3038 2.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5717 2.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4378 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7057 -0.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4378 2.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3038 1.0960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0797 1.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1698 2.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0797 -0.9387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1736 -0.4248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1736 0.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3096 -0.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5814 -1.9348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4455 -1.4315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6663 -1.5316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5033 -3.1414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2264 -3.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0348 2.4060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4378 -0.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2426 -0.7140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4378 3.2160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8407 0.7860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0869 1.7506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5683 3.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7713 3.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0869 -1.5586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6379 0.9289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0358 1.4760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -0.9257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8133 -4.0583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6887 -4.0091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6395 -3.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2533 -3.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 5 2 0 0 0 0 1 6 1 0 0 0 0 2 13 1 0 0 0 0 2 17 1 0 0 0 0 3 12 2 0 0 0 0 6 21 1 0 0 0 0 6 41 1 0 0 0 0 7 26 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 28 1 0 0 0 0 8 29 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 17 2 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 11 20 1 0 0 0 0 13 22 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 14 21 1 0 0 0 0 15 18 1 0 0 0 0 15 31 1 0 0 0 0 16 19 2 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 24 2 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 40 1 0 0 0 0 25 27 3 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 28 42 1 0 0 0 0 29 46 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 30 45 1 0 0 0 0 M CHG 1 4 -1 M END $$$$