BTI1G5
-OEChem-04022102303D
29 30 0 0 0 0 0 0 0999 V2000
0.9894 -2.0644 2.0228 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.8922 -1.2082 -1.4769 F 0 0 0 0 0 0 0 0 0 0 0 0
3.6523 1.5054 -0.7876 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5605 -2.1298 -0.9491 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8777 -0.5073 0.0086 N 0 0 0 0 0 0 0 0 0 0 0 0
1.6793 0.1784 -1.2608 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2332 -0.4801 0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2823 1.5749 -1.1984 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7711 0.9443 0.5245 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8870 -1.2127 0.6055 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4110 -1.2342 -0.1282 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4466 -0.2011 0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6540 -0.2399 -0.5805 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2107 0.8110 1.0471 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6255 0.7335 -0.3474 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1822 1.7845 1.2802 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3897 1.7458 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6402 0.2534 -1.5809 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2104 -0.4177 -2.0131 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8358 -1.1092 -0.1265 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3262 -0.8847 1.5492 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2523 2.0432 -2.1871 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7297 2.2189 -0.5039 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2361 1.5818 1.2385 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8310 0.9503 0.7972 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2814 0.8835 1.6032 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5655 0.7031 -0.8904 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9979 2.5742 2.0027 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1459 2.5040 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 2 0 0 0 0
2 13 1 0 0 0 0
3 8 1 0 0 0 0
3 9 1 0 0 0 0
4 11 2 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 10 1 0 0 0 0
6 8 1 0 0 0 0
6 18 1 0 0 0 0
6 19 1 0 0 0 0
7 9 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 22 1 0 0 0 0
8 23 1 0 0 0 0
9 24 1 0 0 0 0
9 25 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
12 14 2 0 0 0 0
13 15 2 0 0 0 0
14 16 1 0 0 0 0
14 26 1 0 0 0 0
15 17 1 0 0 0 0
15 27 1 0 0 0 0
16 17 2 0 0 0 0
16 28 1 0 0 0 0
17 29 1 0 0 0 0
M END
$$$$