BXSE29
-OEChem-04022107022D
57 59 0 0 0 0 0 0 0999 V2000
5.4641 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4082 1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8067 2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7287 4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9316 4.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9316 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7287 1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2520 3.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8535 3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2742 3.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6728 3.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3860 2.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9875 1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 4.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 4.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 7.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 -5.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 -5.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 -6.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -7.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 -6.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 2 0 0 0 0
2 24 1 0 0 0 0
2 27 1 0 0 0 0
3 9 1 0 0 0 0
3 10 1 0 0 0 0
3 12 1 0 0 0 0
4 5 1 0 0 0 0
4 14 1 0 0 0 0
4 46 1 0 0 0 0
5 20 2 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 11 1 0 0 0 0
6 29 1 0 0 0 0
7 9 1 0 0 0 0
7 30 1 0 0 0 0
7 31 1 0 0 0 0
8 10 1 0 0 0 0
8 32 1 0 0 0 0
8 33 1 0 0 0 0
9 34 1 0 0 0 0
9 35 1 0 0 0 0
10 36 1 0 0 0 0
10 37 1 0 0 0 0
11 13 1 0 0 0 0
11 38 1 0 0 0 0
11 39 1 0 0 0 0
12 14 1 0 0 0 0
12 40 1 0 0 0 0
12 41 1 0 0 0 0
13 15 2 0 0 0 0
13 16 1 0 0 0 0
15 17 1 0 0 0 0
15 42 1 0 0 0 0
16 18 2 0 0 0 0
16 43 1 0 0 0 0
17 19 2 0 0 0 0
17 44 1 0 0 0 0
18 19 1 0 0 0 0
18 45 1 0 0 0 0
19 47 1 0 0 0 0
20 21 1 0 0 0 0
20 48 1 0 0 0 0
21 22 2 0 0 0 0
21 23 1 0 0 0 0
22 25 1 0 0 0 0
22 49 1 0 0 0 0
23 26 2 0 0 0 0
23 50 1 0 0 0 0
24 25 2 0 0 0 0
24 26 1 0 0 0 0
25 51 1 0 0 0 0
26 52 1 0 0 0 0
27 28 1 0 0 0 0
27 53 1 0 0 0 0
27 54 1 0 0 0 0
28 55 1 0 0 0 0
28 56 1 0 0 0 0
28 57 1 0 0 0 0
M END
$$$$