BV82XK
-OEChem-04022106032D
48 49 0 1 0 0 0 0 0999 V2000
6.2160 1.3854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8366 0.1594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6337 2.0899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.0185 3.4216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.6172 2.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6227 2.2990 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
8.0240 3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.3351 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7320 -0.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0349 3.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8147 0.3673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6456 -1.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2215 1.2809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3147 -0.4987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4252 4.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6063 2.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.8351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.3351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5740 1.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2188 2.2535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9872 1.7974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0672 3.9355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4224 3.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.7151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5365 3.4724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6705 3.6096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5334 2.7435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -0.2982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -1.3720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7745 -1.8483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9313 -0.5635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9916 4.0829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6774 4.9015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8588 4.5873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1047 2.2481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9707 2.1110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1079 2.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -4.1451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.9551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 15 1 0 0 0 0
2 9 1 0 0 0 0
2 13 1 0 0 0 0
3 15 2 0 0 0 0
4 7 1 0 0 0 0
4 17 1 0 0 0 0
4 18 1 0 0 0 0
5 6 1 0 0 0 0
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5 24 1 0 0 0 0
5 25 1 0 0 0 0
6 11 1 0 0 0 0
6 26 1 0 0 0 0
7 27 1 0 0 0 0
7 28 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 12 1 0 0 0 0
8 29 1 0 0 0 0
9 14 2 0 0 0 0
10 19 2 0 0 0 0
10 20 1 0 0 0 0
11 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
12 35 1 0 0 0 0
13 15 1 0 0 0 0
13 16 2 0 0 0 0
14 16 1 0 0 0 0
14 36 1 0 0 0 0
16 37 1 0 0 0 0
17 38 1 0 0 0 0
17 39 1 0 0 0 0
17 40 1 0 0 0 0
18 41 1 0 0 0 0
18 42 1 0 0 0 0
18 43 1 0 0 0 0
19 21 1 0 0 0 0
19 44 1 0 0 0 0
20 22 2 0 0 0 0
20 45 1 0 0 0 0
21 23 2 0 0 0 0
21 46 1 0 0 0 0
22 23 1 0 0 0 0
22 47 1 0 0 0 0
23 48 1 0 0 0 0
M END
$$$$