BN1I2G -OEChem-04022109562D 47 49 0 0 0 0 0 0 0999 V2000 6.0010 -0.6224 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.3776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 0.2437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -1.4884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.6224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1434 -1.9271 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.1224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7270 -1.1224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.6224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.1224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.6224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.6224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.6224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.6224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1434 -0.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.6224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4541 0.6329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4541 -2.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.3776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.8776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.2424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.9976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.7424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -0.1474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -0.1474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -1.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -1.5973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0434 0.4403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6467 1.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8647 0.8255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8647 -3.0702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6467 -3.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0434 -2.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2531 2.9602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8546 2.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6412 2.3407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 3.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0212 3.4146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 2 15 1 0 0 0 0 2 26 1 0 0 0 0 5 23 1 0 0 0 0 5 47 1 0 0 0 0 6 22 1 0 0 0 0 6 31 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 7 25 1 0 0 0 0 8 16 2 0 0 0 0 8 18 1 0 0 0 0 9 21 2 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 20 1 0 0 0 0 12 14 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 28 1 0 0 0 0 15 19 1 0 0 0 0 17 19 2 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 30 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$