BPGY79
-OEChem-04012116072D
54 57 0 0 0 0 0 0 0999 V2000
3.0000 -0.6789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5836 0.1258 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5000 -1.5449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5836 -1.4836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.2619 -1.1789 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.3958 -2.6789 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.1562 2.8603 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.1352 3.0645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.5298 -0.1789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0000 -0.6789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5298 -1.1789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 -0.6789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3958 0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2730 1.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2619 -0.1789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3958 -1.6789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3798 1.3626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 -2.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2944 1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1719 0.3280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1799 1.3696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 -1.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2778 1.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -2.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5000 -3.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0479 1.8662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.4109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.9598 1.4560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.6318 2.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1077 -0.0683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4174 -0.4668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8868 1.1637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2935 1.6960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8393 1.6664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4750 -2.8095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4750 -2.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4223 1.8893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6878 1.4104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1666 0.6759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7052 0.0118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2754 2.5104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8923 -3.0215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5826 -2.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9631 -2.9670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1900 -3.8139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0369 -3.5870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9328 -2.9889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8589 -2.9889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 -2.4109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0864 0.8490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6971 3.2770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.2482 2.1293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 2 0 0 0 0
2 9 1 0 0 0 0
2 10 1 0 0 0 0
2 14 1 0 0 0 0
3 12 1 0 0 0 0
3 18 1 0 0 0 0
3 22 1 0 0 0 0
4 10 2 0 0 0 0
4 11 1 0 0 0 0
5 15 1 0 0 0 0
5 16 2 0 0 0 0
6 16 1 0 0 0 0
6 47 1 0 0 0 0
6 48 1 0 0 0 0
7 8 1 0 0 0 0
7 26 1 0 0 0 0
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8 29 2 0 0 0 0
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10 12 1 0 0 0 0
11 16 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
13 15 2 0 0 0 0
13 17 1 0 0 0 0
14 19 1 0 0 0 0
14 32 1 0 0 0 0
14 33 1 0 0 0 0
15 20 1 0 0 0 0
17 23 2 0 0 0 0
17 34 1 0 0 0 0
18 25 1 0 0 0 0
18 35 1 0 0 0 0
18 36 1 0 0 0 0
19 37 1 0 0 0 0
19 38 1 0 0 0 0
19 39 1 0 0 0 0
20 21 2 0 0 0 0
20 40 1 0 0 0 0
21 23 1 0 0 0 0
21 26 1 0 0 0 0
22 24 1 0 0 0 0
23 41 1 0 0 0 0
24 27 1 0 0 0 0
24 42 1 0 0 0 0
24 43 1 0 0 0 0
25 44 1 0 0 0 0
25 45 1 0 0 0 0
25 46 1 0 0 0 0
26 28 2 0 0 0 0
27 49 1 0 0 0 0
27 50 1 0 0 0 0
27 51 1 0 0 0 0
28 29 1 0 0 0 0
28 52 1 0 0 0 0
29 54 1 0 0 0 0
M END
$$$$