B2XM1D
-OEChem-04022109433D
33 34 0 1 0 0 0 0 0999 V2000
4.1270 -0.4801 -0.1971 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5417 0.3328 -2.3305 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2316 -0.2094 -0.1325 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9306 3.1969 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9548 -1.6191 0.1418 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6430 -0.0270 0.2051 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1862 -2.3225 -0.4096 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2948 -1.2752 -0.3713 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3611 0.6840 0.6173 C 0 0 1 0 0 0 0 0 0 0 0 0
0.1070 0.3723 0.3959 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6614 0.4937 -0.8784 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6794 2.0894 0.3064 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9027 -0.0347 1.4668 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0115 0.2082 -1.0817 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2528 -0.3204 1.2634 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8072 -0.1990 -0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8703 -0.8898 0.9493 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8722 -1.8195 1.2182 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0523 -1.9889 -0.3551 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0771 0.8743 -0.2392 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8067 0.0027 1.2903 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0198 -2.6478 -1.4432 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4430 -3.2062 0.1835 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1423 -1.6042 0.2385 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6633 -1.0890 -1.3869 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5646 0.5540 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0446 0.8093 -1.7167 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4853 -0.1348 2.4652 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8095 -0.6312 2.1406 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8451 0.6242 -2.9435 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8983 -1.0718 0.6187 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4956 -1.8350 1.3566 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9150 -0.0984 1.7052 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
1 17 1 0 0 0 0
2 14 1 0 0 0 0
2 30 1 0 0 0 0
3 5 1 0 0 0 0
3 6 1 0 0 0 0
3 9 1 0 0 0 0
4 12 3 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 8 1 0 0 0 0
7 22 1 0 0 0 0
7 23 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 12 1 0 0 0 0
9 26 1 0 0 0 0
10 11 2 0 0 0 0
10 13 1 0 0 0 0
11 14 1 0 0 0 0
11 27 1 0 0 0 0
13 15 2 0 0 0 0
13 28 1 0 0 0 0
14 16 2 0 0 0 0
15 16 1 0 0 0 0
15 29 1 0 0 0 0
17 31 1 0 0 0 0
17 32 1 0 0 0 0
17 33 1 0 0 0 0
M END
$$$$