BV2N9S
-OEChem-04012119412D
50 50 0 0 0 0 0 0 0999 V2000
9.7230 3.0412 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.3569 3.4073 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.7230 4.7733 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 2.8607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 4.8607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9606 6.4053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2287 6.3852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.9550 3.9073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.0890 5.4073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0181 3.3399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9491 0.3162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.2181 3.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2181 4.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1120 2.8260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1005 1.8261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1120 4.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3521 2.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3521 4.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4860 3.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4860 4.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9606 1.3161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0181 4.3815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1005 5.8953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9491 7.4052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 1.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 5.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8093 7.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2230 3.9073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0890 4.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4912 1.9408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8817 1.2460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3521 2.2407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3521 5.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5699 1.2014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1794 1.8962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5538 4.6936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4824 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4086 0.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7303 7.9853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3398 7.2905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 1.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 1.2407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2400 1.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2400 5.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 6.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 5.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1254 7.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3426 8.2314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4931 8.4485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4919 4.2173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 28 1 0 0 0 0
2 28 1 0 0 0 0
3 28 1 0 0 0 0
4 19 1 0 0 0 0
4 25 1 0 0 0 0
5 20 1 0 0 0 0
5 26 1 0 0 0 0
6 23 1 0 0 0 0
6 24 1 0 0 0 0
7 23 2 0 0 0 0
8 29 1 0 0 0 0
8 50 1 0 0 0 0
9 29 2 0 0 0 0
10 14 2 0 0 0 0
10 22 1 0 0 0 0
11 21 1 0 0 0 0
11 37 1 0 0 0 0
11 38 1 0 0 0 0
12 13 1 0 0 0 0
12 14 1 0 0 0 0
12 17 2 0 0 0 0
13 16 1 0 0 0 0
13 18 2 0 0 0 0
14 15 1 0 0 0 0
15 21 1 0 0 0 0
15 30 1 0 0 0 0
15 31 1 0 0 0 0
16 22 2 0 0 0 0
16 23 1 0 0 0 0
17 19 1 0 0 0 0
17 32 1 0 0 0 0
18 20 1 0 0 0 0
18 33 1 0 0 0 0
19 20 2 0 0 0 0
21 34 1 0 0 0 0
21 35 1 0 0 0 0
22 36 1 0 0 0 0
24 27 1 0 0 0 0
24 39 1 0 0 0 0
24 40 1 0 0 0 0
25 41 1 0 0 0 0
25 42 1 0 0 0 0
25 43 1 0 0 0 0
26 44 1 0 0 0 0
26 45 1 0 0 0 0
26 46 1 0 0 0 0
27 47 1 0 0 0 0
27 48 1 0 0 0 0
27 49 1 0 0 0 0
28 29 1 0 0 0 0
M END
$$$$