D0A9JW -OEChem-04152109072D 72 77 0 1 0 0 0 0 0999 V2000 8.0524 -0.9262 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 8.1552 -1.9209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1515 -4.0965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9496 0.0685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8774 1.7459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3335 3.8732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1095 -1.0354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0471 -0.8234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0577 -1.0290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -7.5699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3803 7.3173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -4.7652 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4975 4.0968 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -6.3747 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6973 5.1696 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.5699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 5.3176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -6.0699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6849 6.9630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -4.5699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9895 6.6088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3947 -2.1966 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3919 -3.8147 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3452 -2.5073 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6569 1.6496 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.3435 -3.5073 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8055 -3.0046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9960 3.2317 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4012 2.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7917 2.1511 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0013 3.1288 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7597 0.6549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0873 -1.2450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -5.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0940 5.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6648 -5.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4864 4.1982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -6.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8394 5.6719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -6.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6349 6.6507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -5.0699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9394 6.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7825 -2.0986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7794 -3.9106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2493 -1.8948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2353 1.4264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2454 -4.1195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3455 -2.5890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 -3.4187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6151 3.1981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7647 1.8152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9386 2.6265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3105 2.5421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2245 3.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0305 0.0971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3559 0.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7014 -1.1598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 -0.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7183 -3.8453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3765 2.1112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7268 3.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2848 -5.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8997 3.7360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -0.4455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4107 -1.3256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5581 7.5699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.8799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.9499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8627 7.2157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5273 6.1955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 1 9 2 0 0 0 0 24 2 1 1 0 0 0 26 3 1 1 0 0 0 3 60 1 0 0 0 0 4 32 1 0 0 0 0 30 5 1 1 0 0 0 5 61 1 0 0 0 0 31 6 1 1 0 0 0 6 62 1 0 0 0 0 7 33 1 0 0 0 0 7 65 1 0 0 0 0 8 66 1 0 0 0 0 10 40 2 0 0 0 0 11 41 2 0 0 0 0 23 12 1 6 0 0 0 12 34 1 0 0 0 0 12 36 1 0 0 0 0 28 13 1 6 0 0 0 13 35 1 0 0 0 0 13 37 1 0 0 0 0 14 36 2 0 0 0 0 14 38 1 0 0 0 0 15 37 2 0 0 0 0 15 39 1 0 0 0 0 16 34 1 0 0 0 0 16 42 2 0 0 0 0 17 35 1 0 0 0 0 17 43 2 0 0 0 0 18 40 1 0 0 0 0 18 42 1 0 0 0 0 18 67 1 0 0 0 0 19 41 1 0 0 0 0 19 43 1 0 0 0 0 19 68 1 0 0 0 0 20 42 1 0 0 0 0 20 69 1 0 0 0 0 20 70 1 0 0 0 0 21 43 1 0 0 0 0 21 71 1 0 0 0 0 21 72 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 22 33 1 6 0 0 0 22 44 1 0 0 0 0 23 26 1 0 0 0 0 23 27 1 0 0 0 0 23 45 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 25 29 1 0 0 0 0 25 30 1 0 0 0 0 25 32 1 6 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 34 38 2 0 0 0 0 35 39 2 0 0 0 0 36 63 1 0 0 0 0 37 64 1 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 M END $$$$