BNX0V1
-OEChem-04022102302D
53 55 0 1 0 0 0 0 0999 V2000
1.1311 1.7964 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.4459 4.2298 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
11.1338 1.2675 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
11.7445 3.1720 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.3048 6.6798 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.6708 8.0458 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.6708 6.3138 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
0.3906 2.4684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8717 1.1244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9028 7.1798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0368 8.6798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8078 1.9107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1796 0.5889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3078 3.4495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1.8031 2.5370 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.8352 2.3253 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.5133 1.3346 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.1322 3.0940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4928 1.1259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1168 2.8617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8125 2.5370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8078 1.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4988 2.8617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1229 1.1259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1179 3.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4845 1.7964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4834 3.0940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7805 2.3253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1024 1.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4619 2.0081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0952 3.7009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7672 2.9603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4591 1.0558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1708 7.1798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0368 7.6798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2509 1.8653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1200 1.4624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6546 3.4279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8926 3.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9628 0.8042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7191 0.5487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9857 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7865 0.7155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3212 0.5385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2952 1.2060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2986 3.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6893 0.8723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2845 4.2913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6138 3.1274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 1.4725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0425 0.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9183 0.6392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4398 7.4898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 2 0 0 0 0
1 9 2 0 0 0 0
1 15 1 0 0 0 0
1 33 1 0 0 0 0
2 25 1 0 0 0 0
3 30 1 0 0 0 0
4 32 1 0 0 0 0
5 34 1 0 0 0 0
6 34 1 0 0 0 0
7 34 1 0 0 0 0
10 35 1 0 0 0 0
10 53 1 0 0 0 0
11 35 2 0 0 0 0
12 19 1 0 0 0 0
12 20 1 0 0 0 0
12 22 1 0 0 0 0
17 13 1 1 0 0 0
13 42 1 0 0 0 0
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14 20 2 0 0 0 0
14 23 1 0 0 0 0
15 28 1 0 0 0 0
15 49 1 0 0 0 0
16 17 1 0 0 0 0
16 18 1 0 0 0 0
16 21 1 6 0 0 0
16 36 1 0 0 0 0
17 19 1 0 0 0 0
17 37 1 0 0 0 0
18 20 1 0 0 0 0
18 38 1 0 0 0 0
18 39 1 0 0 0 0
19 40 1 0 0 0 0
19 41 1 0 0 0 0
21 25 1 0 0 0 0
21 26 2 0 0 0 0
22 23 2 0 0 0 0
22 24 1 0 0 0 0
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24 29 2 0 0 0 0
24 44 1 0 0 0 0
25 31 2 0 0 0 0
26 30 1 0 0 0 0
26 45 1 0 0 0 0
27 28 2 0 0 0 0
27 46 1 0 0 0 0
28 29 1 0 0 0 0
29 47 1 0 0 0 0
30 32 2 0 0 0 0
31 32 1 0 0 0 0
31 48 1 0 0 0 0
33 50 1 0 0 0 0
33 51 1 0 0 0 0
33 52 1 0 0 0 0
34 35 1 0 0 0 0
M END
$$$$