BK70EO
-OEChem-04042105583D
34 36 0 0 0 0 0 0 0999 V2000
0.8642 2.0253 0.0034 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3002 -1.9913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9802 -2.2282 0.0008 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5193 2.1549 0.0038 N 0 0 0 0 0 0 0 0 0 0 0 0
0.0498 -0.0504 0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1908 0.7076 0.0027 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9874 0.9015 0.0032 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5985 0.4251 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4020 0.6538 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2879 0.2887 -1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2906 0.2847 1.2075 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0908 0.5311 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0871 0.5357 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0157 -1.4816 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6555 0.0147 -1.2104 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6584 0.0107 1.2055 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4648 0.2907 1.2053 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4610 0.2953 -1.2105 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3409 -0.1242 -0.0035 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1500 0.1727 -0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4386 -3.4167 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7689 0.3938 -2.1584 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7739 0.3866 2.1591 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5716 0.6196 2.1594 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5650 0.6278 -2.1574 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1870 -0.0905 -2.1517 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1920 -0.0977 2.1452 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0012 0.1948 2.1448 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9945 0.2029 -2.1521 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4058 -0.3375 -0.0051 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2198 -0.0148 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9825 -3.8382 -0.9022 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5056 -3.6542 -0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9833 -3.8403 0.8983 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 1 0 0 0 0
1 6 1 0 0 0 0
2 14 1 0 0 0 0
2 21 1 0 0 0 0
3 14 2 0 0 0 0
4 7 2 0 0 0 0
5 6 2 0 0 0 0
5 7 1 0 0 0 0
5 14 1 0 0 0 0
6 8 1 0 0 0 0
7 9 1 0 0 0 0
8 10 2 0 0 0 0
8 11 1 0 0 0 0
9 12 2 0 0 0 0
9 13 1 0 0 0 0
10 15 1 0 0 0 0
10 22 1 0 0 0 0
11 16 2 0 0 0 0
11 23 1 0 0 0 0
12 17 1 0 0 0 0
12 24 1 0 0 0 0
13 18 2 0 0 0 0
13 25 1 0 0 0 0
15 19 2 0 0 0 0
15 26 1 0 0 0 0
16 19 1 0 0 0 0
16 27 1 0 0 0 0
17 20 2 0 0 0 0
17 28 1 0 0 0 0
18 20 1 0 0 0 0
18 29 1 0 0 0 0
19 30 1 0 0 0 0
20 31 1 0 0 0 0
21 32 1 0 0 0 0
21 33 1 0 0 0 0
21 34 1 0 0 0 0
M END
$$$$