BZJ12K
-OEChem-04012113143D
37 40 0 0 0 0 0 0 0999 V2000
-4.8767 0.0987 0.0029 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1813 -0.4669 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1345 0.8878 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8271 1.3085 -0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0
1.2588 2.4321 -0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2544 -0.8527 -0.0027 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1706 1.2624 0.0007 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7556 3.6692 0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0
4.4609 -1.1357 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5881 -2.0220 -1.2575 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5902 -2.0104 1.2683 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6737 -0.1724 -0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0632 -0.0444 -0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9514 -1.0781 -0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8243 1.1343 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3038 0.0447 -0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0580 2.4880 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3763 -0.0616 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7343 -0.6365 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0247 -1.9809 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4366 -2.0781 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9083 -0.7859 0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5633 -2.5212 -1.2947 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8226 -2.8057 -1.2835 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4801 -1.4264 -2.1717 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8235 -2.7926 1.3032 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5649 -2.5103 1.3079 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4849 -1.4061 2.1771 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6211 -0.7240 -0.0021 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6694 0.4709 -0.8911 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6712 0.4779 0.8795 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8303 -2.1527 -0.0026 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2711 4.5603 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7701 3.6954 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3180 -2.7993 -0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0356 -2.9772 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8969 -0.3508 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
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3 15 2 0 0 0 0
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9 10 1 0 0 0 0
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11 26 1 0 0 0 0
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11 28 1 0 0 0 0
12 29 1 0 0 0 0
12 30 1 0 0 0 0
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13 14 2 0 0 0 0
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13 16 1 0 0 0 0
14 32 1 0 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
20 21 1 0 0 0 0
20 35 1 0 0 0 0
21 22 2 0 0 0 0
21 36 1 0 0 0 0
22 37 1 0 0 0 0
M END
$$$$