D0X2HT -OEChem-04152110072D 55 59 0 1 0 0 0 0 0999 V2000 3.7320 -3.6522 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9634 -0.1972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6522 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7320 -3.6522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.6522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.6522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8927 -1.2011 0.0000 N 0 3 3 0 0 0 0 0 0 0 0 0 5.4217 -0.7255 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2454 -1.2011 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0690 -0.7255 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -1.2011 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9712 -0.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 0.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3239 -0.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0690 0.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2454 0.7011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1521 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2454 -2.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 -2.6277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8487 -1.4945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2454 1.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 2.1277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.1521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.6522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.1522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7918 -1.8522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3604 -1.5240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7816 -1.4375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 0.5766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4116 0.2387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0315 -1.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 0.1557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2309 0.5849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6796 0.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2811 0.8081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7823 -2.4622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 -3.2477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6667 -2.0872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4414 -1.6765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0306 -0.9018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7823 1.9622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4217 2.7477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 4.6522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.2722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 4.6522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.6891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.8422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.6152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 2 13 1 0 0 0 0 2 21 1 0 0 0 0 19 3 1 6 0 0 0 4 25 1 0 0 0 0 4 27 1 0 0 0 0 8 27 2 0 0 0 0 9 12 1 0 0 0 0 9 16 1 0 0 0 0 9 23 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 1 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 31 1 1 0 0 0 12 17 1 0 0 0 0 12 32 1 6 0 0 0 13 19 1 0 0 0 0 13 33 1 1 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 24 1 0 0 0 0 19 22 1 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 20 42 1 0 0 0 0 21 25 2 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$