BZ8K2P
-OEChem-04012120062D
48 50 0 0 0 0 0 0 0999 V2000
6.6132 -4.8533 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.1132 0.6856 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5016 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.6132 -4.8533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6132 -4.8533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.4753 4.1307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.8766 3.1126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 -0.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 -1.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8042 -0.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 -3.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4223 -0.2655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4793 -2.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7472 -2.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8532 -0.5745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1132 0.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4793 -3.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7472 -3.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6453 -1.5526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1100 0.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 -5.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7010 1.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 -1.8617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 -0.2144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9511 -1.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2943 2.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8821 3.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0631 4.9397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6564 5.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0119 -0.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0162 -2.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2103 -2.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0162 -3.6633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2103 -3.6633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1060 -1.9675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2389 0.7011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9932 -5.8533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 -6.4733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2332 -5.8533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3176 1.4298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5653 -2.4681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6982 0.2005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6777 2.4730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4938 4.4937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5771 5.2864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2228 6.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4042 6.4197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0900 5.6011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 11 1 0 0 0 0
1 21 1 0 0 0 0
2 10 1 0 0 0 0
2 16 1 0 0 0 0
3 25 1 0 0 0 0
6 27 1 0 0 0 0
6 28 1 0 0 0 0
7 27 2 0 0 0 0
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8 10 2 0 0 0 0
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9 13 2 0 0 0 0
9 14 1 0 0 0 0
10 15 1 0 0 0 0
11 17 2 0 0 0 0
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14 18 2 0 0 0 0
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15 19 2 0 0 0 0
15 20 1 0 0 0 0
16 22 1 0 0 0 0
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18 34 1 0 0 0 0
19 23 1 0 0 0 0
19 35 1 0 0 0 0
20 24 2 0 0 0 0
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26 27 1 0 0 0 0
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28 29 1 0 0 0 0
28 44 1 0 0 0 0
28 45 1 0 0 0 0
29 46 1 0 0 0 0
29 47 1 0 0 0 0
29 48 1 0 0 0 0
M END
$$$$