B05MNR
-OEChem-04012113582D
73 76 0 1 0 0 0 0 0999 V2000
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8.3548 -1.3669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5783 -4.4890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.3548 2.0972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2712 -1.3056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9355 -2.7942 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.3548 0.3651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9785 -2.3818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.8548 -0.5009 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.2712 0.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3250 -1.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3250 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9140 -3.0004 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.5819 -2.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2247 -3.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8548 -0.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4590 -1.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4590 0.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5568 -4.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2032 -4.1572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5929 -1.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5929 -0.0009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2677 -3.5385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2892 -3.3323 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
9.3548 0.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6213 -4.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8548 1.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8548 -0.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8548 1.2312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8548 -0.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3548 2.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.3548 0.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8548 2.9632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3548 3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8548 2.9632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8548 4.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.3548 3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8548 4.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1365 -1.0532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8086 0.6131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0202 0.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7214 -2.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4173 -4.5403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4590 -2.1209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4590 1.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7429 -2.2049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0954 -4.2812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1428 -5.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0183 -5.1093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0753 -4.7638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8099 -4.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3310 -3.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0560 -1.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0560 0.3091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0448 0.9021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6825 -3.2044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1599 -3.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2073 -4.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0828 -4.4907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3926 -1.9203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5448 -1.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1648 1.7681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1279 -1.5689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3933 -2.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8721 -2.7822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1648 -1.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.9748 0.3651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7348 3.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1648 2.4263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5448 5.2322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.9748 3.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1648 5.2322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 2 0 0 0 0
2 16 2 0 0 0 0
3 23 2 0 0 0 0
4 32 2 0 0 0 0
5 9 1 0 0 0 0
5 11 1 0 0 0 0
5 14 1 0 0 0 0
13 6 1 6 0 0 0
6 23 1 0 0 0 0
6 47 1 0 0 0 0
7 16 1 0 0 0 0
7 25 1 0 0 0 0
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24 8 1 6 0 0 0
8 30 1 0 0 0 0
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15 19 1 0 0 0 0
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35 69 1 0 0 0 0
36 38 2 0 0 0 0
36 70 1 0 0 0 0
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38 39 1 0 0 0 0
38 72 1 0 0 0 0
39 73 1 0 0 0 0
M END
$$$$