BM72KB
-OEChem-04012113592D
34 36 0 0 0 0 0 0 0999 V2000
3.6180 3.6072 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.2212 3.8284 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.4316 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.5100 0.0233 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.0308 -3.8284 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
4.7628 -3.8284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8968 0.6716 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0878 1.2594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.8968 -3.3284 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
4.7058 1.2594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8968 -0.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6569 0.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3968 2.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3968 2.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7628 -0.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0308 -0.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4000 1.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8648 -0.0278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7628 -1.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0308 -1.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8968 -2.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3511 1.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8158 -0.3368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5590 0.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7612 2.7120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2998 -0.5184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4938 -0.5184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2711 2.2259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4040 -0.4427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2998 -2.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4938 -2.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8118 1.7253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9448 -0.9433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
2 19 1 0 0 0 0
3 19 1 0 0 0 0
4 25 1 0 0 0 0
5 9 1 0 0 0 0
6 9 2 0 0 0 0
7 8 1 0 0 0 0
7 10 1 0 0 0 0
7 11 1 0 0 0 0
8 14 2 0 0 0 0
9 22 1 0 0 0 0
10 12 1 0 0 0 0
10 13 2 0 0 0 0
11 15 2 0 0 0 0
11 16 1 0 0 0 0
12 17 2 0 0 0 0
12 18 1 0 0 0 0
13 14 1 0 0 0 0
13 26 1 0 0 0 0
14 19 1 0 0 0 0
15 20 1 0 0 0 0
15 27 1 0 0 0 0
16 21 2 0 0 0 0
16 28 1 0 0 0 0
17 23 1 0 0 0 0
17 29 1 0 0 0 0
18 24 2 0 0 0 0
18 30 1 0 0 0 0
20 22 2 0 0 0 0
20 31 1 0 0 0 0
21 22 1 0 0 0 0
21 32 1 0 0 0 0
23 25 2 0 0 0 0
23 33 1 0 0 0 0
24 25 1 0 0 0 0
24 34 1 0 0 0 0
M CHG 2 5 -1 9 1
M END
$$$$