BUI13D -OEChem-04012115413D 43 45 0 0 0 0 0 0 0999 V2000 -3.9680 -2.9977 0.4590 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0666 -0.1148 -1.0089 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8384 1.8431 1.5584 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3604 1.1051 -0.6478 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1039 -1.2333 -0.5767 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3165 -2.7164 0.9164 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0172 -0.5074 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2519 -1.9534 0.5365 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -0.9607 -0.4548 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4729 -2.2986 0.2486 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 0.6946 -0.7651 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0023 -2.0689 0.9681 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -1.2345 0.5467 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7958 0.5776 -0.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9599 1.9286 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4604 -0.0755 1.2556 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9089 -1.6049 -0.5601 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5399 0.7134 0.8579 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3038 0.3432 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9882 -0.8159 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3416 1.6944 0.5846 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5055 3.0455 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6963 2.9284 0.5009 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2108 3.0522 1.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0889 0.6559 -1.7889 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8119 -1.1687 -1.8075 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4572 -0.1844 -2.3326 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2658 -3.4744 1.5867 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2528 -2.8342 1.6995 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3330 -0.3625 0.0072 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0321 2.0347 -1.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8696 0.2195 2.1201 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -2.5058 -1.1218 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5361 -1.1649 -1.8265 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2725 1.6052 1.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0034 4.0063 -0.2816 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1221 3.7982 0.9924 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5516 3.8612 1.7875 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1226 2.9691 1.2202 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4905 3.2917 0.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4651 0.6502 -2.6893 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5677 -0.3123 -1.6067 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 1.3794 -1.9636 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 9 2 0 0 0 0 3 18 1 0 0 0 0 3 24 1 0 0 0 0 4 19 1 0 0 0 0 4 25 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 28 1 0 0 0 0 7 11 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 21 1 0 0 0 0 14 30 1 0 0 0 0 15 22 2 0 0 0 0 15 31 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$