B25ABN
-OEChem-04022100262D
42 44 0 0 0 0 0 0 0999 V2000
6.6622 2.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.6622 1.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.3050 1.0034 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.6622 3.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.4282 3.4122 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.6622 2.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.6622 1.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1654 -3.1785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6622 -2.2306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.1622 -3.7694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 -3.1785 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.6622 1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6622 0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6622 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6622 1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6622 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5282 0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7962 0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5282 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7962 -0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4712 -2.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8532 -2.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1622 -3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4223 -2.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9021 -2.5094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 -1.5312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7431 -1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2079 -2.8695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.8913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0652 0.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2592 0.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0652 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2592 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3522 1.2325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5266 -4.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9108 -2.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1312 -1.9619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1550 -1.1163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6142 -0.6157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7551 -2.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7472 -3.2843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4103 -1.6997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 1 0 0 0 0
2 15 1 0 0 0 0
3 15 1 0 0 0 0
4 16 1 0 0 0 0
5 16 1 0 0 0 0
6 16 1 0 0 0 0
7 12 1 0 0 0 0
7 34 1 0 0 0 0
8 24 1 0 0 0 0
8 40 1 0 0 0 0
9 14 1 0 0 0 0
9 21 1 0 0 0 0
9 22 1 0 0 0 0
10 22 2 0 0 0 0
10 23 1 0 0 0 0
11 25 1 0 0 0 0
11 28 2 0 0 0 0
12 13 1 0 0 0 0
12 15 1 0 0 0 0
12 16 1 0 0 0 0
13 17 2 0 0 0 0
13 18 1 0 0 0 0
14 19 2 0 0 0 0
14 20 1 0 0 0 0
17 19 1 0 0 0 0
17 30 1 0 0 0 0
18 20 2 0 0 0 0
18 31 1 0 0 0 0
19 32 1 0 0 0 0
20 33 1 0 0 0 0
21 23 2 0 0 0 0
21 24 1 0 0 0 0
22 25 1 0 0 0 0
23 35 1 0 0 0 0
24 36 1 0 0 0 0
24 37 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
26 38 1 0 0 0 0
27 29 2 0 0 0 0
27 39 1 0 0 0 0
28 29 1 0 0 0 0
28 41 1 0 0 0 0
29 42 1 0 0 0 0
M END
$$$$