D02XPB
-OEChem-10101305022D
50 52 0 0 0 0 0 0 0999 V2000
4.5981 3.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -5.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -5.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -4.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -5.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 6.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 6.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 6.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9875 -0.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3860 -1.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6762 2.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0747 3.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -4.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 4.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 4.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 7.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 2.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 1.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -5.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 14 1 0 0 0 0
2 10 1 0 0 0 0
2 27 1 0 0 0 0
3 7 1 0 0 0 0
3 12 1 0 0 0 0
3 31 1 0 0 0 0
4 23 1 0 0 0 0
4 48 1 0 0 0 0
4 49 1 0 0 0 0
5 23 2 0 0 0 0
5 50 1 0 0 0 0
6 7 1 0 0 0 0
6 8 2 0 0 0 0
6 11 1 0 0 0 0
7 28 1 0 0 0 0
7 29 1 0 0 0 0
8 10 1 0 0 0 0
8 30 1 0 0 0 0
9 10 2 0 0 0 0
9 13 1 0 0 0 0
11 13 2 0 0 0 0
11 32 1 0 0 0 0
12 15 2 0 0 0 0
12 16 1 0 0 0 0
13 33 1 0 0 0 0
14 17 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 19 1 0 0 0 0
15 36 1 0 0 0 0
16 20 2 0 0 0 0
16 37 1 0 0 0 0
17 21 2 0 0 0 0
17 22 1 0 0 0 0
18 19 2 0 0 0 0
18 20 1 0 0 0 0
18 23 1 0 0 0 0
19 38 1 0 0 0 0
20 39 1 0 0 0 0
21 24 1 0 0 0 0
21 40 1 0 0 0 0
22 25 2 0 0 0 0
22 41 1 0 0 0 0
24 26 2 0 0 0 0
24 42 1 0 0 0 0
25 26 1 0 0 0 0
25 43 1 0 0 0 0
26 44 1 0 0 0 0
27 45 1 0 0 0 0
27 46 1 0 0 0 0
27 47 1 0 0 0 0
M END
$$$$