BH4DW7
-OEChem-04022107453D
43 46 0 0 0 0 0 0 0999 V2000
5.3445 1.0228 0.1197 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0153 0.7313 -2.3036 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1989 0.1859 0.0145 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0174 0.8304 0.0301 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.0764 -2.0707 0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2910 -3.7328 0.0199 N 0 0 0 0 0 0 0 0 0 0 0 0
1.0213 -3.1417 0.0506 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.4835 0.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6424 1.9187 -1.2172 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6322 1.8850 1.2388 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7177 3.3311 -0.6482 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3329 3.1340 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0791 -1.1721 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7207 -1.4357 0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1211 -0.1624 0.0397 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2870 0.1439 0.0574 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3359 -2.7722 0.0332 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5836 -3.3281 0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9830 0.2929 -1.1422 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9541 0.2903 1.2735 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3462 0.5887 -1.1257 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3173 0.5857 1.2901 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0133 0.7350 0.0906 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9507 1.1561 1.4038 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2861 0.2366 -0.0154 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5842 1.6835 -1.7282 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8379 1.8214 -1.9529 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6594 2.1561 1.6655 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2082 1.3928 2.0291 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3088 4.0013 -1.2788 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7092 3.7511 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1768 3.9960 1.3806 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4114 2.9569 0.6398 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3222 -4.1224 -0.0058 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4648 0.1784 -2.0921 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4250 0.1762 2.2169 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7550 -2.4487 0.0603 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2574 -4.1250 0.0518 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7695 0.6846 2.2709 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3943 0.5954 -3.0397 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0087 1.3851 1.2385 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9131 0.2176 1.9673 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5277 1.9966 1.9646 H 0 0 0 0 0 0 0 0 0 0 0 0
1 23 1 0 0 0 0
1 24 1 0 0 0 0
2 21 1 0 0 0 0
2 40 1 0 0 0 0
3 4 1 0 0 0 0
3 8 1 0 0 0 0
3 13 1 0 0 0 0
4 15 2 0 0 0 0
5 13 2 0 0 0 0
5 18 1 0 0 0 0
6 17 1 0 0 0 0
6 18 2 0 0 0 0
7 17 1 0 0 0 0
7 37 1 0 0 0 0
7 38 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 25 1 0 0 0 0
9 11 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 28 1 0 0 0 0
10 29 1 0 0 0 0
11 12 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 32 1 0 0 0 0
12 33 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
14 17 2 0 0 0 0
15 16 1 0 0 0 0
16 19 2 0 0 0 0
16 20 1 0 0 0 0
18 34 1 0 0 0 0
19 21 1 0 0 0 0
19 35 1 0 0 0 0
20 22 2 0 0 0 0
20 36 1 0 0 0 0
21 23 2 0 0 0 0
22 23 1 0 0 0 0
22 39 1 0 0 0 0
24 41 1 0 0 0 0
24 42 1 0 0 0 0
24 43 1 0 0 0 0
M END
$$$$