B40LAN
-OEChem-04022105062D
78 81 0 1 0 0 0 0 0999 V2000
13.7988 7.8291 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
7.7988 4.3650 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.6979 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.3319 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.6979 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.2988 12.1593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2988 13.8913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.9300 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0640 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.2988 8.6952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.2988 10.4272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7988 13.0253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.7988 11.2932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.2988 8.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7988 9.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7988 9.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2988 10.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7988 7.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7988 11.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7988 11.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7988 7.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2988 6.9631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2988 12.1593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2988 12.1593 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.2152 12.2206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2152 13.8300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7988 13.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2690 12.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2690 13.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2988 8.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7988 6.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2988 6.9631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2988 6.9631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 12.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 14.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.2988 8.6952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2988 5.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.2988 6.9631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7988 6.0971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.7988 7.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2988 5.2311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5369 12.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5369 13.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1979 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0640 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7162 8.4831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4065 8.0846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2738 9.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2738 9.9597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3239 9.9597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3239 9.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8814 10.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1912 11.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1088 8.3661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2162 11.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9065 10.6827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8814 12.3713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1912 12.7698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6788 12.1593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9642 11.6537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7526 11.9113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7526 14.1392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9642 14.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9888 9.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4188 6.0971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9888 6.4262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9888 7.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1088 10.7563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1788 11.2932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 11.4053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 14.6453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6088 9.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6088 4.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6088 6.4262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1788 6.0971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 12.2153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0000 13.8353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4669 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 40 1 0 0 0 0
2 41 1 0 0 0 0
3 44 1 0 0 0 0
4 44 1 0 0 0 0
5 44 1 0 0 0 0
6 19 2 0 0 0 0
7 27 2 0 0 0 0
8 45 1 0 0 0 0
8 78 1 0 0 0 0
9 45 2 0 0 0 0
10 14 1 0 0 0 0
10 15 1 0 0 0 0
10 18 1 0 0 0 0
11 16 1 0 0 0 0
11 17 1 0 0 0 0
11 19 1 0 0 0 0
12 25 1 0 0 0 0
12 26 1 0 0 0 0
12 27 1 0 0 0 0
24 13 1 6 0 0 0
13 68 1 0 0 0 0
13 69 1 0 0 0 0
14 16 1 0 0 0 0
14 46 1 0 0 0 0
14 47 1 0 0 0 0
15 17 1 0 0 0 0
15 48 1 0 0 0 0
15 49 1 0 0 0 0
16 50 1 0 0 0 0
16 51 1 0 0 0 0
17 52 1 0 0 0 0
17 53 1 0 0 0 0
18 21 1 0 0 0 0
18 22 1 0 0 0 0
18 54 1 0 0 0 0
19 20 1 0 0 0 0
20 23 1 0 0 0 0
20 55 1 0 0 0 0
20 56 1 0 0 0 0
21 30 2 0 0 0 0
21 32 1 0 0 0 0
22 31 2 0 0 0 0
22 33 1 0 0 0 0
23 24 1 0 0 0 0
23 57 1 0 0 0 0
23 58 1 0 0 0 0
24 27 1 0 0 0 0
24 59 1 0 0 0 0
25 28 1 0 0 0 0
25 60 1 0 0 0 0
25 61 1 0 0 0 0
26 29 1 0 0 0 0
26 62 1 0 0 0 0
26 63 1 0 0 0 0
28 29 1 0 0 0 0
28 34 2 0 0 0 0
29 35 2 0 0 0 0
30 36 1 0 0 0 0
30 64 1 0 0 0 0
31 37 1 0 0 0 0
31 65 1 0 0 0 0
32 38 2 0 0 0 0
32 66 1 0 0 0 0
33 39 2 0 0 0 0
33 67 1 0 0 0 0
34 42 1 0 0 0 0
34 70 1 0 0 0 0
35 43 1 0 0 0 0
35 71 1 0 0 0 0
36 40 2 0 0 0 0
36 72 1 0 0 0 0
37 41 2 0 0 0 0
37 73 1 0 0 0 0
38 40 1 0 0 0 0
38 74 1 0 0 0 0
39 41 1 0 0 0 0
39 75 1 0 0 0 0
42 43 2 0 0 0 0
42 76 1 0 0 0 0
43 77 1 0 0 0 0
44 45 1 0 0 0 0
M END
$$$$