D0S0PI -OEChem-10191523032D 47 50 0 1 0 0 0 0 0999 V2000 5.7969 -0.3413 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0384 0.5585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5781 1.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3024 2.8164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3384 3.1421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4539 1.2793 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.7317 1.4634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.7026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.3121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5397 0.8742 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.9889 0.2479 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5781 1.0559 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9917 1.8659 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0401 1.5586 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2321 2.1477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7112 0.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5192 -0.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4334 -0.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4129 -1.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2414 -0.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2209 -2.1088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1352 -1.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8586 0.5030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6043 1.9618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4872 1.2780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6365 2.3197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9594 1.5910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 1.5905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8883 3.2779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -1.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1579 0.4938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3654 0.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8374 3.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8461 -1.7709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8083 -0.4582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 -2.7253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6361 -2.0690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14 1 1 1 0 0 0 1 21 1 0 0 0 0 2 14 1 0 0 0 0 2 17 1 0 0 0 0 15 3 1 1 0 0 0 3 36 1 0 0 0 0 16 4 1 1 0 0 0 4 37 1 0 0 0 0 5 18 1 0 0 0 0 5 42 1 0 0 0 0 6 24 2 0 0 0 0 7 13 1 0 0 0 0 8 13 2 0 0 0 0 9 14 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 20 2 0 0 0 0 10 22 1 0 0 0 0 11 19 1 0 0 0 0 11 25 1 0 0 0 0 11 41 1 0 0 0 0 12 24 1 0 0 0 0 12 25 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 6 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 22 2 0 0 0 0 20 38 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 24 1 0 0 0 0 23 26 1 0 0 0 0 23 27 2 0 0 0 0 25 43 1 0 0 0 0 26 28 2 0 0 0 0 27 29 1 0 0 0 0 27 44 1 0 0 0 0 28 30 1 0 0 0 0 28 45 1 0 0 0 0 29 30 2 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M CHG 2 7 -1 13 1 M END $$$$