B6D8FU
-OEChem-04012117582D
37 40 0 1 0 0 0 0 0999 V2000
4.3198 1.7484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5381 0.7380 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7925 -1.2831 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
6.9343 -0.7862 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.9343 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0682 -1.2862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8443 0.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6580 -0.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6836 0.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0682 0.7138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2022 -0.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2022 0.2138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7851 -2.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8523 1.7623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0522 1.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3083 -1.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3083 0.7485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9502 2.2831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4022 0.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4022 -0.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9339 -1.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6697 -1.7611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4668 -1.7611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8597 -1.3852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2708 -0.7046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2907 0.0665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9154 0.7675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1651 -2.2785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7805 -2.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4051 -2.2877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3904 2.0702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5117 2.0591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3154 -1.9408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9478 2.9031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8665 -1.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7865 2.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 17 1 0 0 0 0
1 36 1 0 0 0 0
2 19 1 0 0 0 0
2 37 1 0 0 0 0
3 4 1 0 0 0 0
3 8 1 0 0 0 0
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5 7 2 0 0 0 0
5 10 1 0 0 0 0
6 11 1 0 0 0 0
6 22 1 0 0 0 0
6 23 1 0 0 0 0
7 9 1 0 0 0 0
7 14 1 0 0 0 0
8 9 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 12 1 0 0 0 0
10 15 2 0 0 0 0
11 12 2 0 0 0 0
11 16 1 0 0 0 0
12 17 1 0 0 0 0
13 28 1 0 0 0 0
13 29 1 0 0 0 0
13 30 1 0 0 0 0
14 18 2 0 0 0 0
14 31 1 0 0 0 0
15 18 1 0 0 0 0
15 32 1 0 0 0 0
16 20 2 0 0 0 0
16 33 1 0 0 0 0
17 19 2 0 0 0 0
18 34 1 0 0 0 0
19 20 1 0 0 0 0
20 35 1 0 0 0 0
M END
$$$$