B14FJB
-OEChem-04012113503D
40 42 0 0 0 0 0 0 0999 V2000
1.3421 3.0443 -0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0015 2.6784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2332 0.6122 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0080 1.3423 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8352 0.2580 -1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8353 0.2576 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3092 0.8193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6383 -0.8039 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0373 -0.4499 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0373 -0.4501 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1118 1.9260 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7989 -0.5310 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2236 0.6185 -2.5243 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2241 0.6183 2.5247 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9229 -1.5616 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5659 2.1436 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0367 -1.1866 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0370 -1.1865 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5126 -2.4979 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5129 -2.4977 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7506 -3.1534 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5086 -0.7315 -2.1468 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5088 -0.7319 2.1465 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3100 0.0447 -2.6971 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9034 0.4015 -3.3562 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0012 1.6890 -2.5786 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3097 0.0459 2.6972 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0033 1.6892 2.5794 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9035 0.3999 3.3566 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7240 -2.6378 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5268 -1.3163 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5267 -1.3160 -0.8806 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0222 1.6936 0.8871 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0221 1.6933 -0.8872 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8128 3.2101 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8687 -0.6887 -2.1592 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8691 -0.6886 2.1593 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7004 -3.0074 -2.1485 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7010 -3.0072 2.1485 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1224 -4.1738 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 11 1 0 0 0 0
2 4 2 0 0 0 0
3 4 1 0 0 0 0
3 5 2 0 0 0 0
3 6 1 0 0 0 0
4 7 1 0 0 0 0
5 9 1 0 0 0 0
5 13 1 0 0 0 0
6 10 2 0 0 0 0
6 14 1 0 0 0 0
7 11 2 0 0 0 0
7 12 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
8 15 1 0 0 0 0
9 22 1 0 0 0 0
10 23 1 0 0 0 0
11 16 1 0 0 0 0
12 17 2 0 0 0 0
12 18 1 0 0 0 0
13 24 1 0 0 0 0
13 25 1 0 0 0 0
13 26 1 0 0 0 0
14 27 1 0 0 0 0
14 28 1 0 0 0 0
14 29 1 0 0 0 0
15 30 1 0 0 0 0
15 31 1 0 0 0 0
15 32 1 0 0 0 0
16 33 1 0 0 0 0
16 34 1 0 0 0 0
16 35 1 0 0 0 0
17 19 1 0 0 0 0
17 36 1 0 0 0 0
18 20 2 0 0 0 0
18 37 1 0 0 0 0
19 21 2 0 0 0 0
19 38 1 0 0 0 0
20 21 1 0 0 0 0
20 39 1 0 0 0 0
21 40 1 0 0 0 0
M END
$$$$