BCH4P3
-OEChem-04022109423D
38 41 0 0 0 0 0 0 0999 V2000
-3.1948 -0.9464 -0.0443 S 0 0 0 0 0 0 0 0 0 0 0 0
1.7914 -0.5361 0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8418 -2.6747 0.0411 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5530 -3.0408 -0.0047 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1082 0.5613 -0.0176 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3920 -0.0891 1.3226 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6484 -0.3904 -1.1245 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8591 1.3618 1.2001 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0920 1.0617 -1.2778 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7695 1.5642 -0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2816 1.8133 0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6169 -0.7873 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1001 3.0506 -0.3903 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4905 0.6014 -0.0341 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6709 -1.3356 0.0301 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4684 3.0719 0.3045 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3167 1.8490 -0.0758 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6664 -1.6984 -0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2686 -3.4367 0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2349 -0.7437 1.5752 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6683 -0.1599 2.1438 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1091 -0.6912 -2.0312 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5174 -1.0528 -1.0293 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4109 1.6295 2.1094 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0323 2.0653 1.1447 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2692 1.7168 -1.5647 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8107 1.1211 -2.1047 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0248 2.6245 -0.1116 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7102 1.0214 0.1481 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0538 1.9541 1.0397 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5567 1.7356 -0.6672 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5379 3.9571 -0.1392 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2506 3.0569 -1.4776 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0091 3.9878 0.0402 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3182 3.0916 1.3917 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7073 1.9814 -1.0924 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1747 1.7770 0.6021 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1045 -4.5086 0.0319 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
1 18 1 0 0 0 0
2 6 1 0 0 0 0
2 7 1 0 0 0 0
2 15 1 0 0 0 0
3 15 1 0 0 0 0
3 19 2 0 0 0 0
4 18 2 0 0 0 0
4 19 1 0 0 0 0
5 11 1 0 0 0 0
5 12 1 0 0 0 0
5 14 2 0 0 0 0
6 8 1 0 0 0 0
6 20 1 0 0 0 0
6 21 1 0 0 0 0
7 9 1 0 0 0 0
7 22 1 0 0 0 0
7 23 1 0 0 0 0
8 10 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 10 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 13 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 15 2 0 0 0 0
12 18 1 0 0 0 0
13 16 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 17 1 0 0 0 0
16 17 1 0 0 0 0
16 34 1 0 0 0 0
16 35 1 0 0 0 0
17 36 1 0 0 0 0
17 37 1 0 0 0 0
19 38 1 0 0 0 0
M END
$$$$