D00721 -OEChem-05072121572D 66 69 0 0 0 0 0 0 0999 V2000 3.0000 -0.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 5.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9939 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4103 2.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 1.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4103 3.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6995 1.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 4.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0102 0.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9219 -1.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5234 -2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4766 -2.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0781 -1.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5234 -2.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9219 -3.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0781 -3.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4766 -2.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -5.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6106 -4.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -4.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -5.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1951 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1072 1.1574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7004 0.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3133 1.1259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7200 1.6582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3103 4.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9136 5.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1317 4.9479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5234 4.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9219 3.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4208 -0.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2028 -0.5013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5995 0.2806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 5.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 17 1 0 0 0 0 4 22 1 0 0 0 0 4 32 1 0 0 0 0 5 29 2 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 24 1 0 0 0 0 9 29 1 0 0 0 0 9 51 1 0 0 0 0 10 24 2 0 0 0 0 11 26 2 0 0 0 0 11 28 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 15 1 0 0 0 0 13 37 1 0 0 0 0 13 38 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 15 42 1 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 21 1 0 0 0 0 19 48 1 0 0 0 0 20 23 2 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 50 1 0 0 0 0 25 28 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 30 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 31 1 0 0 0 0 30 33 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 34 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 M END $$$$