D04WCI -OEChem-10101305022D 49 51 0 0 0 0 0 0 0999 V2000 4.5981 0.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.8718 0.4692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -2.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -2.5242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -2.5347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.9792 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -2.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -2.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -1.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -2.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8680 -0.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4604 -1.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4599 -3.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2569 -3.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7902 -0.4441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 -1.1328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1258 -3.1441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0778 -1.1143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4789 -0.4255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1285 -1.5608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3315 -1.5577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3509 0.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4099 0.7771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1304 -2.2296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 29 1 0 0 0 0 3 15 1 0 0 0 0 3 45 1 0 0 0 0 4 14 1 0 0 0 0 4 46 1 0 0 0 0 5 22 1 0 0 0 0 5 24 1 0 0 0 0 6 21 2 0 0 0 0 7 11 1 0 0 0 0 7 16 1 0 0 0 0 7 35 1 0 0 0 0 8 17 1 0 0 0 0 8 21 1 0 0 0 0 8 23 1 0 0 0 0 9 16 1 0 0 0 0 9 17 2 0 0 0 0 10 16 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 20 22 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 2 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 M END $$$$