L3IK7Y
-OEChem-05022323022D
45 47 0 1 0 0 0 0 0999 V2000
2.8660 2.7282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.7718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.7718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.2282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.7026 3.7227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.6808 3.9306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.7282 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 -0.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.7282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.2282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1808 3.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5116 2.3214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1753 2.9600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9595 4.3918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5820 2.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7631 3.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5765 1.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7576 3.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.2718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1643 2.7510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.3482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.9182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 1.7651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.5382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 0.6912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6405 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.4618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.4618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3743 4.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4987 4.8067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5446 3.9311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2176 1.5449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5109 4.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8287 1.3756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1220 4.1661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7809 2.6862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.3918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 11 2 0 0 0 0
2 25 1 0 0 0 0
2 45 1 0 0 0 0
3 25 2 0 0 0 0
7 4 1 1 0 0 0
4 11 1 0 0 0 0
4 28 1 0 0 0 0
5 6 1 0 0 0 0
5 9 1 0 0 0 0
5 20 1 0 0 0 0
6 12 2 0 0 0 0
7 8 1 0 0 0 0
7 10 1 0 0 0 0
7 27 1 0 0 0 0
8 14 2 0 0 0 0
8 15 1 0 0 0 0
9 11 1 0 0 0 0
9 13 2 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
12 13 1 0 0 0 0
12 16 1 0 0 0 0
13 32 1 0 0 0 0
14 17 1 0 0 0 0
14 33 1 0 0 0 0
15 18 2 0 0 0 0
15 34 1 0 0 0 0
16 21 2 0 0 0 0
16 22 1 0 0 0 0
17 19 2 0 0 0 0
17 35 1 0 0 0 0
18 19 1 0 0 0 0
18 36 1 0 0 0 0
19 25 1 0 0 0 0
20 37 1 0 0 0 0
20 38 1 0 0 0 0
20 39 1 0 0 0 0
21 23 1 0 0 0 0
21 40 1 0 0 0 0
22 24 2 0 0 0 0
22 41 1 0 0 0 0
23 26 2 0 0 0 0
23 42 1 0 0 0 0
24 26 1 0 0 0 0
24 43 1 0 0 0 0
26 44 1 0 0 0 0
M END
$$$$