BNTL71
-OEChem-04022105593D
50 52 0 1 0 0 0 0 0999 V2000
-0.2713 3.6448 1.7752 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1606 4.1696 -1.1517 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9157 -3.0113 0.0158 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7598 -3.4760 1.7060 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5700 -1.0823 -2.0886 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.3154 -1.1911 0.0721 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0502 2.2593 -0.1448 C 0 0 1 0 0 0 0 0 0 0 0 0
1.5453 2.6232 -0.3106 C 0 0 1 0 0 0 0 0 0 0 0 0
-0.1133 0.9663 0.7222 C 0 0 2 0 0 0 0 0 0 0 0 0
2.2668 1.4670 -1.0173 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9761 -0.0851 0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0946 0.1594 -0.2959 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7546 3.4177 0.4678 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7709 3.9128 -1.1062 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5159 0.3841 0.5433 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8985 -1.3138 1.2025 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0650 -0.8418 -0.4682 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9083 -0.0881 -0.7026 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3807 0.3340 1.6289 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8763 -2.2950 1.0375 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9560 -2.0622 0.1946 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1876 -0.6197 -0.8657 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6601 -0.1973 1.4657 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0635 -0.6742 0.2185 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7156 -3.9446 -1.0444 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3108 -2.4559 -2.3721 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3517 2.0901 -1.1531 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0018 2.7504 0.6818 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0075 1.2541 1.7764 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3385 1.6907 -1.0863 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8903 1.3479 -2.0415 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8174 3.1625 0.5317 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6852 4.3379 -0.1169 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3061 4.7758 -0.6244 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3881 3.8262 -2.1284 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0660 -1.5146 1.8734 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9189 -0.6614 -1.1181 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2315 -0.0571 -1.5526 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0797 0.7024 2.6054 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7985 4.3678 2.1554 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2861 4.9850 -1.6664 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3324 -0.2336 2.3187 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5392 -4.0226 1.5065 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7064 -3.4286 -2.0098 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7806 -4.4964 -0.9052 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5460 -4.6559 -1.0358 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7778 -1.1480 0.9267 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8364 -3.1021 -1.6619 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2354 -2.6576 -2.3391 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6766 -2.6729 -3.3794 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 40 1 0 0 0 0
2 14 1 0 0 0 0
2 41 1 0 0 0 0
3 21 1 0 0 0 0
3 25 1 0 0 0 0
4 20 1 0 0 0 0
4 43 1 0 0 0 0
5 22 1 0 0 0 0
5 26 1 0 0 0 0
6 24 1 0 0 0 0
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8 10 1 0 0 0 0
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8 28 1 0 0 0 0
9 11 1 0 0 0 0
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10 12 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 12 1 0 0 0 0
11 16 2 0 0 0 0
12 17 2 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 18 2 0 0 0 0
15 19 1 0 0 0 0
16 20 1 0 0 0 0
16 36 1 0 0 0 0
17 21 1 0 0 0 0
17 37 1 0 0 0 0
18 22 1 0 0 0 0
18 38 1 0 0 0 0
19 23 2 0 0 0 0
19 39 1 0 0 0 0
20 21 2 0 0 0 0
22 24 2 0 0 0 0
23 24 1 0 0 0 0
23 42 1 0 0 0 0
25 44 1 0 0 0 0
25 45 1 0 0 0 0
25 46 1 0 0 0 0
26 48 1 0 0 0 0
26 49 1 0 0 0 0
26 50 1 0 0 0 0
M END
$$$$