BG19NC
-OEChem-04012114512D
78 81 0 0 0 0 0 0 0999 V2000
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13.1244 1.9470 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
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6.3301 -0.5530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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18.5347 -2.3577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 -1.0530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 -1.0530 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.8564 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.9904 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
17.5885 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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14.1244 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.9904 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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16.7224 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.1244 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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13.2583 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
19.1183 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.1244 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9966 -0.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1996 -0.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -0.5160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -1.5899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4860 0.4470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2460 0.4470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5560 -2.0160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -2.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1760 -3.0899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2881 -3.0899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -2.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9081 -2.0160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0656 -1.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8626 -1.5279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
16.7224 0.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.3195 -2.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.1244 -1.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.5273 0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
16.7224 -3.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
18.7273 -0.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
18.7273 -2.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.7214 0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5252 0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
19.7383 -1.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.3923 -1.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 1.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 -1.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2803 1.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 2.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0403 1.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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43 78 1 0 0 0 0
M END
$$$$