BI3R0K
-OEChem-04012113333D
32 32 0 0 0 0 0 0 0999 V2000
-0.2211 -0.1874 -1.5149 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.7253 1.3196 -0.6058 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6591 1.8461 1.4105 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9172 -0.1624 1.1584 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4688 -0.0217 -0.9481 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6240 -0.2782 0.0236 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1433 -0.4933 -0.3565 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9513 0.2237 -0.5443 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6181 -0.8184 -0.5918 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6913 0.0034 -0.2512 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6171 -2.1604 -0.2144 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7662 -0.5181 0.4687 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6921 -2.6819 0.5053 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7666 -1.8608 0.8468 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0488 0.0072 0.4078 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1553 2.1821 0.3434 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2414 3.6004 -0.1372 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6693 -0.5453 -1.8914 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4180 1.0513 -1.1726 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6940 -1.3521 0.2393 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4177 0.2224 0.9786 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9369 0.0372 0.5793 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2038 -1.5633 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1735 -0.2948 -1.4841 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8770 1.2925 -0.7759 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7981 -2.8249 -0.4776 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6079 0.1145 0.7377 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6940 -3.7279 0.7976 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6040 -2.2670 1.4064 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6930 3.7053 -1.0766 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7906 4.2635 0.6065 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2889 3.8826 -0.2684 H 0 0 0 0 0 0 0 0 0 0 0 0
1 7 1 0 0 0 0
1 9 1 0 0 0 0
2 10 1 0 0 0 0
2 16 1 0 0 0 0
3 16 2 0 0 0 0
4 15 3 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 18 1 0 0 0 0
5 19 1 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 22 1 0 0 0 0
7 23 1 0 0 0 0
8 15 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 11 2 0 0 0 0
10 12 2 0 0 0 0
11 13 1 0 0 0 0
11 26 1 0 0 0 0
12 14 1 0 0 0 0
12 27 1 0 0 0 0
13 14 2 0 0 0 0
13 28 1 0 0 0 0
14 29 1 0 0 0 0
16 17 1 0 0 0 0
17 30 1 0 0 0 0
17 31 1 0 0 0 0
17 32 1 0 0 0 0
M END
$$$$