B0MWE5
-OEChem-04012116112D
69 71 0 0 0 0 0 0 0999 V2000
2.8660 0.4806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.5194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.7844 5.1195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 4.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.5194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.8301 6.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.8334 5.4285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1391 5.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5211 5.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8301 6.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0902 4.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -6.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6762 1.3980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0747 2.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3860 2.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9875 1.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2520 3.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8535 2.8729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8101 -0.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2087 0.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5422 2.8980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9407 3.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6540 -0.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2554 -1.6271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1996 -1.9944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9966 -1.9944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9315 4.8768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4657 6.5210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5947 -0.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7976 -0.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -4.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2191 4.1529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -0.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5252 -2.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 -1.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -3.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 -2.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -5.4825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -6.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -6.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2452 5.5343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 2 0 0 0 0
2 21 2 0 0 0 0
3 29 1 0 0 0 0
3 36 1 0 0 0 0
4 9 1 0 0 0 0
4 69 1 0 0 0 0
5 15 1 0 0 0 0
5 16 1 0 0 0 0
5 17 1 0 0 0 0
6 14 1 0 0 0 0
6 19 1 0 0 0 0
6 20 1 0 0 0 0
7 21 1 0 0 0 0
7 25 1 0 0 0 0
7 55 1 0 0 0 0
8 19 2 0 0 0 0
8 24 1 0 0 0 0
9 28 2 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 37 1 0 0 0 0
10 38 1 0 0 0 0
11 13 1 0 0 0 0
11 39 1 0 0 0 0
11 40 1 0 0 0 0
12 14 1 0 0 0 0
12 41 1 0 0 0 0
12 42 1 0 0 0 0
13 15 1 0 0 0 0
13 43 1 0 0 0 0
13 44 1 0 0 0 0
14 45 1 0 0 0 0
14 46 1 0 0 0 0
16 18 1 0 0 0 0
16 47 1 0 0 0 0
16 48 1 0 0 0 0
17 21 1 0 0 0 0
17 49 1 0 0 0 0
17 50 1 0 0 0 0
18 22 2 0 0 0 0
18 23 1 0 0 0 0
19 28 1 0 0 0 0
20 24 2 0 0 0 0
20 51 1 0 0 0 0
22 26 1 0 0 0 0
22 52 1 0 0 0 0
23 27 2 0 0 0 0
23 53 1 0 0 0 0
24 54 1 0 0 0 0
25 30 1 0 0 0 0
25 56 1 0 0 0 0
25 57 1 0 0 0 0
26 29 2 0 0 0 0
26 58 1 0 0 0 0
27 29 1 0 0 0 0
27 59 1 0 0 0 0
28 60 1 0 0 0 0
30 31 2 0 0 0 0
30 32 1 0 0 0 0
31 33 1 0 0 0 0
31 61 1 0 0 0 0
32 34 2 0 0 0 0
32 62 1 0 0 0 0
33 35 2 0 0 0 0
33 63 1 0 0 0 0
34 35 1 0 0 0 0
34 64 1 0 0 0 0
35 65 1 0 0 0 0
36 66 1 0 0 0 0
36 67 1 0 0 0 0
36 68 1 0 0 0 0
M END
$$$$