BXL94J
-OEChem-04012116292D
38 38 0 1 0 0 0 0 0999 V2000
2.8660 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.7320 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.7500 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 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 0.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 0.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8101 1.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2087 2.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 0.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7741 3.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1541 4.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0420 4.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4220 3.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2460 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4860 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 2 0 0 0 0
2 3 1 0 0 0 0
2 7 1 0 0 0 0
2 8 1 1 0 0 0
2 17 1 0 0 0 0
3 6 1 0 0 0 0
3 18 1 0 0 0 0
3 19 1 0 0 0 0
4 5 1 0 0 0 0
4 9 1 0 0 0 0
4 10 1 0 0 0 0
4 20 1 0 0 0 0
5 6 1 0 0 0 0
5 21 1 0 0 0 0
5 22 1 0 0 0 0
7 11 2 0 0 0 0
7 12 1 0 0 0 0
8 23 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 26 1 0 0 0 0
9 27 1 0 0 0 0
9 28 1 0 0 0 0
10 29 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 13 1 0 0 0 0
11 32 1 0 0 0 0
12 14 2 0 0 0 0
12 33 1 0 0 0 0
13 15 2 0 0 0 0
13 34 1 0 0 0 0
14 15 1 0 0 0 0
14 35 1 0 0 0 0
15 16 1 0 0 0 0
16 36 1 0 0 0 0
16 37 1 0 0 0 0
16 38 1 0 0 0 0
M END
$$$$