BFE2B3
-OEChem-04022106552D
65 69 0 1 0 0 0 0 0999 V2000
8.9063 -4.2946 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
10.6384 -5.2946 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.1846 4.0921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0826 3.2915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2416 2.0044 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.9166 4.0921 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.1384 0.2443 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.1384 0.2443 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.4474 -0.7068 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.0506 2.5921 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
9.5506 1.0533 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
9.8596 2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5506 1.0533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0506 3.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8302 3.6854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0211 5.0867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2905 2.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.4993 4.4285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.9993 5.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5474 1.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8294 -0.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5963 1.9532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6384 -1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8532 1.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6384 -2.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9021 1.5931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7724 -2.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5044 -2.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 0.9240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 2.5713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7724 -3.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5044 -3.7946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2079 1.2330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7431 2.8803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6384 -4.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.2112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4982 2.8736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1630 1.1503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4260 1.7522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1696 2.5413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9441 0.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6154 0.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5202 3.1485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.3318 3.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9563 5.7033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4011 5.0867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.9142 3.9678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0009 4.7930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5657 5.5467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8077 5.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2563 1.0968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0359 1.2625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2397 -0.8984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8874 2.5007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1078 2.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5621 0.7367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3417 0.9024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2354 -2.4846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0413 -2.4846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2879 0.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1550 2.9862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0413 -4.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7472 0.8182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6142 3.4868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4103 2.4028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 31 1 0 0 0 0
2 35 1 0 0 0 0
3 14 2 0 0 0 0
4 17 2 0 0 0 0
5 10 1 0 0 0 0
5 13 1 0 0 0 0
5 17 1 0 0 0 0
6 14 1 0 0 0 0
6 15 1 0 0 0 0
6 16 1 0 0 0 0
7 8 1 0 0 0 0
11 7 1 6 0 0 0
7 21 1 0 0 0 0
8 9 2 0 0 0 0
9 23 1 0 0 0 0
10 12 1 0 0 0 0
10 14 1 6 0 0 0
10 37 1 0 0 0 0
11 12 1 0 0 0 0
11 13 1 0 0 0 0
11 38 1 0 0 0 0
12 39 1 0 0 0 0
12 40 1 0 0 0 0
13 41 1 0 0 0 0
13 42 1 0 0 0 0
15 18 1 0 0 0 0
15 43 1 0 0 0 0
15 44 1 0 0 0 0
16 19 1 0 0 0 0
16 45 1 0 0 0 0
16 46 1 0 0 0 0
17 20 1 0 0 0 0
18 19 1 0 0 0 0
18 47 1 0 0 0 0
18 48 1 0 0 0 0
19 49 1 0 0 0 0
19 50 1 0 0 0 0
20 22 1 0 0 0 0
20 51 1 0 0 0 0
20 52 1 0 0 0 0
21 23 2 0 0 0 0
21 53 1 0 0 0 0
22 24 1 0 0 0 0
22 54 1 0 0 0 0
22 55 1 0 0 0 0
23 25 1 0 0 0 0
24 26 1 0 0 0 0
24 56 1 0 0 0 0
24 57 1 0 0 0 0
25 27 2 0 0 0 0
25 28 1 0 0 0 0
26 29 2 0 0 0 0
26 30 1 0 0 0 0
27 31 1 0 0 0 0
27 58 1 0 0 0 0
28 32 2 0 0 0 0
28 59 1 0 0 0 0
29 33 1 0 0 0 0
29 60 1 0 0 0 0
30 34 2 0 0 0 0
30 61 1 0 0 0 0
31 35 2 0 0 0 0
32 35 1 0 0 0 0
32 62 1 0 0 0 0
33 36 2 0 0 0 0
33 63 1 0 0 0 0
34 36 1 0 0 0 0
34 64 1 0 0 0 0
36 65 1 0 0 0 0
M END
$$$$