BRK85D
-OEChem-04022109223D
36 39 0 0 0 0 0 0 0999 V2000
-0.5527 -1.2178 -0.1212 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9921 2.6520 0.6239 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8394 2.2086 0.7298 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7414 2.6169 -0.4395 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1283 1.1042 0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2609 1.4788 -1.3238 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3078 -0.1984 0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6911 0.2469 -0.5618 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7382 -0.5605 0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5025 1.3426 0.3773 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4015 0.3048 0.1039 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8764 -0.9772 -0.1404 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0475 -0.1150 -0.5492 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1879 -1.7243 0.7572 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7900 0.5208 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4681 -1.2683 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5393 -2.0737 0.7594 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7685 -2.0114 -0.4092 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6609 -0.5302 -0.1977 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1489 -1.7986 -0.4397 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3808 3.1030 1.1581 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4750 1.8462 1.5513 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5949 3.1719 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2004 3.3236 -1.0819 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0903 1.8607 -1.9328 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4902 1.1866 -2.0497 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7858 0.4985 -1.0596 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4867 -2.3680 1.2849 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2449 1.4898 0.2502 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5197 -1.5397 0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8654 -2.9738 1.2725 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3917 -3.0142 -0.6024 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9757 2.8359 0.7487 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3838 3.4541 0.5528 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7330 -0.3602 -0.2217 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8201 -2.6254 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0
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5 10 2 0 0 0 0
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9 14 2 0 0 0 0
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11 12 1 0 0 0 0
11 15 2 0 0 0 0
12 18 2 0 0 0 0
13 16 1 0 0 0 0
13 27 1 0 0 0 0
14 17 1 0 0 0 0
14 28 1 0 0 0 0
15 19 1 0 0 0 0
15 29 1 0 0 0 0
16 17 2 0 0 0 0
16 30 1 0 0 0 0
17 31 1 0 0 0 0
18 20 1 0 0 0 0
18 32 1 0 0 0 0
19 20 2 0 0 0 0
19 35 1 0 0 0 0
20 36 1 0 0 0 0
M END
$$$$