B9WZC1 -OEChem-04012118342D 58 61 0 0 0 0 0 0 0999 V2000 5.4641 -2.8170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.8170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -1.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -3.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 -1.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 -3.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 0.7656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 0.0754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -3.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -3.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 0.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 0.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 -3.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 -3.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.8730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 1.8730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -3.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1233 -1.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 3.4930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -3.1270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.5070 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 10 1 0 0 0 0 1 12 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 7 10 2 0 0 0 0 7 13 1 0 0 0 0 8 11 1 0 0 0 0 8 13 2 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 15 1 0 0 0 0 11 15 2 0 0 0 0 12 17 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 14 18 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 16 19 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 18 22 2 0 0 0 0 18 23 1 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 26 1 0 0 0 0 20 44 1 0 0 0 0 21 27 2 0 0 0 0 21 45 1 0 0 0 0 22 28 1 0 0 0 0 22 46 1 0 0 0 0 23 29 2 0 0 0 0 23 47 1 0 0 0 0 24 30 1 0 0 0 0 24 48 1 0 0 0 0 25 31 2 0 0 0 0 25 49 1 0 0 0 0 26 32 2 0 0 0 0 26 50 1 0 0 0 0 27 32 1 0 0 0 0 27 51 1 0 0 0 0 28 33 2 0 0 0 0 28 52 1 0 0 0 0 29 33 1 0 0 0 0 29 53 1 0 0 0 0 30 34 2 0 0 0 0 30 54 1 0 0 0 0 31 34 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 M END $$$$