B6BVX1
-OEChem-04022102303D
29 30 0 0 0 0 0 0 0999 V2000
1.0439 -1.8558 2.2114 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.5624 2.4196 1.3636 F 0 0 0 0 0 0 0 0 0 0 0 0
3.4713 1.6721 -0.8536 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1395 -2.5647 -0.8440 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9220 -0.4666 0.0738 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1921 -0.1560 0.7151 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7714 0.0014 -1.2971 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5212 1.3195 0.5333 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1598 1.4703 -1.3919 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9808 -1.2306 0.6785 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2109 -1.5539 -0.1574 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4032 -0.6717 -0.1652 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4225 0.4819 0.6187 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5057 -0.9962 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5442 1.3112 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6274 -0.1671 -0.9626 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6466 0.9867 -0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9483 -0.7678 0.2078 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2282 -0.4006 1.7778 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7744 -0.1309 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4623 -0.6008 -1.9001 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8249 1.9563 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5324 1.5280 0.8963 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1744 1.7898 -2.4385 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4475 2.1081 -0.8551 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5824 0.7751 1.2402 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5115 -1.8901 -1.5739 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4859 -0.4195 -1.5781 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5196 1.6326 -0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 2 0 0 0 0
2 15 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 2 0 0 0 0
12 14 1 0 0 0 0
13 15 1 0 0 0 0
13 26 1 0 0 0 0
14 16 2 0 0 0 0
14 27 1 0 0 0 0
15 17 2 0 0 0 0
16 17 1 0 0 0 0
16 28 1 0 0 0 0
17 29 1 0 0 0 0
M END
$$$$