7a,12a-Dihydroxy-3-oxo-4-cholenoic acid.mol
Mrv0541 02231218322D
32 35 0 0 0 0 999 V2000
-2.5040 -2.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5040 -1.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7895 -1.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7895 -2.9126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0750 -2.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3606 -2.9126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3539 -2.5001 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
0.3539 -1.6751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
1.0684 -1.2626 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
1.8530 -1.5175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3379 -0.8501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8530 -0.1826 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
2.1079 0.6020 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
1.5888 1.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8844 2.0133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6993 2.1424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9149 0.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0684 -0.4376 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
1.0684 0.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3539 -0.0251 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
-0.3606 -0.4376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3606 -1.2626 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
-1.0750 -1.6751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.0750 -0.8501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9949 2.9126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2184 1.5012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2184 -2.9126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3539 0.7999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0684 -2.9126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3606 -2.0876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3539 -0.8501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0684 -2.0876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
1 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
12 11 1 1 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
13 17 1 1 0 0 0
12 18 1 0 0 0 0
9 18 1 0 0 0 0
18 19 1 1 0 0 0
18 20 1 0 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
8 22 1 0 0 0 0
22 23 1 0 0 0 0
3 23 1 0 0 0 0
5 23 1 0 0 0 0
23 24 1 1 0 0 0
16 25 2 0 0 0 0
16 26 1 0 0 0 0
1 27 2 0 0 0 0
20 28 1 6 0 0 0
7 29 1 6 0 0 0
22 30 1 6 0 0 0
8 31 1 1 0 0 0
9 32 1 6 0 0 0
M END