D0G4CS -OEChem-10191521512D 64 68 0 1 0 0 0 0 0999 V2000 10.5161 0.6257 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.4218 -2.7144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2626 3.6228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7880 -0.3810 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9251 -3.5746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9162 1.1157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7764 2.6190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0444 2.6123 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 0.4647 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5857 -0.3526 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.4537 -0.8492 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.6559 -0.8776 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9184 -1.8426 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6323 -2.0642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3375 1.4823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2054 0.9856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4218 -2.7105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7841 0.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6482 1.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9123 2.1157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6443 2.1223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 2.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 2.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 1.0882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 2.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 2.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 2.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1896 1.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 0.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 0.5535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 1.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8209 -0.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0879 -1.1904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3909 4.1127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8480 0.0696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1914 -1.2714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1655 -1.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3236 -2.3118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2657 -2.5642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2341 -2.2136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1359 2.0686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7918 1.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2522 -0.6930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6172 -4.1127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5451 -3.5722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1801 2.4344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0832 3.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3294 3.2703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 3.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 3.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 2.6271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 1.9747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 1.2016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -0.0664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 0.7553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1573 -1.0311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3922 -0.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6662 -0.7359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6334 -1.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5096 -1.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6946 4.6532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8504 4.4165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0871 3.5722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 18 2 0 0 0 0 3 28 1 0 0 0 0 3 35 1 0 0 0 0 4 30 2 0 0 0 0 13 5 1 6 0 0 0 5 19 1 0 0 0 0 5 44 1 0 0 0 0 6 18 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 19 2 0 0 0 0 7 21 1 0 0 0 0 8 21 2 0 0 0 0 8 22 1 0 0 0 0 9 21 1 0 0 0 0 9 27 1 0 0 0 0 9 50 1 0 0 0 0 10 25 1 0 0 0 0 10 30 1 0 0 0 0 10 33 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 11 36 1 6 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 17 1 0 0 0 0 12 37 1 1 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 18 1 6 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 19 20 1 0 0 0 0 20 22 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 23 28 1 0 0 0 0 24 26 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 31 1 0 0 0 0 26 29 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 M END $$$$