BK8OA0
-OEChem-04012112402D
62 64 0 1 0 0 0 0 0999 V2000
5.5000 3.0366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4751 -0.4026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 -0.4275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9392 -2.4026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 1.3045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2071 -3.4026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5000 1.3045 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.2071 0.5974 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.2071 2.0116 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
7.9142 1.3045 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.5000 1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2071 -0.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2071 3.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9142 1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 2.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3411 -0.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 0.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0731 -0.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 0.4385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0731 -1.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 2.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3411 -1.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2071 -2.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 3.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6090 -0.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 -0.4275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8052 -1.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3411 -3.9026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1747 2.0898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4218 0.2721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6343 2.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1515 0.7317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8271 3.0116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2071 3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5871 3.0116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9142 0.6845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5342 1.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9142 1.9245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3100 -0.0984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6101 -0.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6900 2.7075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8042 -2.2126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5369 4.2126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6900 4.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4631 3.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2990 -0.3657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0721 -1.2126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9190 -1.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 0.1925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8800 -0.4275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 -1.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1152 -2.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3421 -1.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4952 -1.3657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 2.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 2.7075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.8605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0311 -3.3657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8042 -4.2126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6511 -4.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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5 29 1 0 0 0 0
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6 30 1 0 0 0 0
7 8 1 0 0 0 0
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7 11 1 0 0 0 0
7 31 1 1 0 0 0
8 10 1 0 0 0 0
8 12 1 0 0 0 0
8 32 1 6 0 0 0
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9 33 1 0 0 0 0
10 14 1 1 0 0 0
10 34 1 0 0 0 0
11 15 1 0 0 0 0
11 17 2 0 0 0 0
12 16 1 0 0 0 0
12 18 2 0 0 0 0
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14 39 1 0 0 0 0
14 40 1 0 0 0 0
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18 42 1 0 0 0 0
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20 24 2 0 0 0 0
21 23 1 0 0 0 0
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22 24 1 0 0 0 0
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25 45 1 0 0 0 0
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27 51 1 0 0 0 0
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28 56 1 0 0 0 0
29 57 1 0 0 0 0
29 58 1 0 0 0 0
29 59 1 0 0 0 0
30 60 1 0 0 0 0
30 61 1 0 0 0 0
30 62 1 0 0 0 0
M END
$$$$