BWOD27
-OEChem-04012119272D
51 55 0 1 0 0 0 0 0999 V2000
9.7984 1.3032 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.2917 -0.1672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7685 -3.6385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.8872 -1.5333 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
5.3000 -1.9435 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.9123 0.4912 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.9123 -1.3107 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.2888 -2.0926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4784 -0.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6690 -0.9098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6690 0.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1097 -2.5082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8872 0.7137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8428 -1.0608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6029 -2.6523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8618 -1.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7127 -2.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5630 -1.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5630 0.6249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1097 1.6886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4691 -0.9306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0799 -0.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7818 -2.5753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4691 0.1110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1490 -0.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0653 1.9834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3767 2.3688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2878 2.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5992 3.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5548 3.6385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1171 -1.8960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0913 -2.6803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8333 -2.3891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9937 -0.0232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9937 -0.7963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5053 -2.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2477 -3.1126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7142 -2.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5558 -2.0644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5558 1.2448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0048 -1.2427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1723 0.0155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6894 -3.1883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0048 0.4231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6643 -0.5764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4229 -2.1783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7842 2.1861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8803 3.1411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1447 3.7654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6927 4.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
2 14 2 0 0 0 0
3 15 2 0 0 0 0
4 7 1 0 0 0 0
4 10 1 0 0 0 0
4 12 1 0 0 0 0
5 8 1 0 0 0 0
5 14 1 0 0 0 0
5 15 1 0 0 0 0
6 9 1 0 0 0 0
6 13 2 0 0 0 0
7 8 1 0 0 0 0
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7 32 1 0 0 0 0
8 33 1 0 0 0 0
8 34 1 0 0 0 0
9 35 1 0 0 0 0
9 36 1 0 0 0 0
10 11 1 0 0 0 0
10 18 2 0 0 0 0
11 13 1 0 0 0 0
11 19 2 0 0 0 0
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13 20 1 0 0 0 0
14 16 1 0 0 0 0
15 17 1 0 0 0 0
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19 24 1 0 0 0 0
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20 27 1 0 0 0 0
20 28 2 0 0 0 0
21 24 2 0 0 0 0
21 42 1 0 0 0 0
22 25 1 0 0 0 0
22 43 1 0 0 0 0
23 26 1 0 0 0 0
23 44 1 0 0 0 0
24 45 1 0 0 0 0
25 26 2 0 0 0 0
25 46 1 0 0 0 0
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27 29 2 0 0 0 0
28 30 1 0 0 0 0
28 48 1 0 0 0 0
29 31 1 0 0 0 0
29 49 1 0 0 0 0
30 31 2 0 0 0 0
30 50 1 0 0 0 0
31 51 1 0 0 0 0
M END
$$$$