B5W0LS
-OEChem-04012114552D
48 51 0 1 0 0 0 0 0999 V2000
4.6557 0.0355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7244 0.0355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6691 3.1624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4264 -4.1589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0074 4.6487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.3834 -4.5714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1945 0.5355 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.1945 -0.4645 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.2435 0.8445 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.1407 -0.7693 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.2435 -0.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1407 0.8402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9344 1.7955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4514 -1.7198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9563 2.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7836 -2.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6036 2.5387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4299 -1.9260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6473 2.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0942 -3.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2946 3.4897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7406 -2.8765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3164 3.6976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0727 -3.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7370 -5.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1956 1.3854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1956 -1.3146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6311 0.9415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7532 -0.8655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7065 -1.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4956 -1.3400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6781 1.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8897 1.4071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5414 1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1769 -2.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2100 2.4098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8440 -1.4646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7094 3.9505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3472 -3.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4222 5.1094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9901 -4.6992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5392 2.8341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5851 1.9585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4608 2.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1477 -5.3021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9296 -5.6988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3264 -4.9168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 11 1 0 0 0 0
2 10 1 0 0 0 0
2 12 1 0 0 0 0
3 19 1 0 0 0 0
3 25 1 0 0 0 0
4 20 1 0 0 0 0
4 26 1 0 0 0 0
5 23 1 0 0 0 0
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7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 12 1 0 0 0 0
7 27 1 6 0 0 0
8 10 1 0 0 0 0
8 11 1 0 0 0 0
8 28 1 6 0 0 0
9 13 1 1 0 0 0
9 29 1 0 0 0 0
10 14 1 1 0 0 0
10 30 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 33 1 0 0 0 0
12 34 1 0 0 0 0
13 15 2 0 0 0 0
13 17 1 0 0 0 0
14 16 2 0 0 0 0
14 18 1 0 0 0 0
15 19 1 0 0 0 0
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16 20 1 0 0 0 0
16 36 1 0 0 0 0
17 21 2 0 0 0 0
17 37 1 0 0 0 0
18 22 2 0 0 0 0
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20 24 2 0 0 0 0
21 23 1 0 0 0 0
21 39 1 0 0 0 0
22 24 1 0 0 0 0
22 40 1 0 0 0 0
25 43 1 0 0 0 0
25 44 1 0 0 0 0
25 45 1 0 0 0 0
26 46 1 0 0 0 0
26 47 1 0 0 0 0
26 48 1 0 0 0 0
M END
$$$$