BH4DW7
-OEChem-04012118262D
43 46 0 0 0 0 0 0 0999 V2000
5.9209 3.6179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2566 2.1293 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -1.7936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 -0.9889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.9889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.4889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -2.7442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4026 -3.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9405 -3.0515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9917 -4.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9422 -4.0515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.1842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 0.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 0.9726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3211 1.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2781 1.9231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6318 2.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6103 2.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2531 4.3622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4266 -2.3050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9411 -3.1401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9425 -3.9699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5572 -3.1153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0684 -2.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4553 -4.6731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2449 -4.9282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0722 -4.6578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5587 -3.9857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.7989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3815 0.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7144 1.3828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 1.3211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.3211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2177 2.9226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6707 1.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7145 4.7763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8390 4.8237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7916 3.9481 0.0000 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
$$$$