B01DZW
-OEChem-04022101062D
50 54 0 1 0 0 0 0 0999 V2000
3.7070 2.0889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7893 2.2505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.8880 0.3664 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.7380 0.5480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2893 1.3844 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.8720 1.0480 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.9584 0.6413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7674 2.0426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2948 1.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3858 -0.4941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9155 0.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7226 -1.2346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 -0.8278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6040 1.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8271 -2.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.4156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4700 0.5480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6040 2.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0181 -2.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1045 -2.4101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3361 1.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3361 2.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4700 2.5480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2300 0.5134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2300 2.5827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1361 1.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1361 2.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9516 1.9044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3919 1.3857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4568 0.2769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2684 0.1044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3874 2.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8322 2.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5371 2.8169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7380 -0.0720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8016 -0.9540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8869 -0.1289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8516 0.7772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2955 0.1618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3935 -2.4813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4336 -1.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4700 -0.0720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0671 2.3580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0829 -3.4335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6029 -2.7746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4700 3.1680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2228 -0.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2228 3.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6718 0.7152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6718 2.3809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 2 0 0 0 0
2 5 1 0 0 0 0
2 8 1 0 0 0 0
2 34 1 0 0 0 0
3 9 1 0 0 0 0
3 10 1 0 0 0 0
3 11 1 0 0 0 0
6 4 1 6 0 0 0
4 14 1 0 0 0 0
4 35 1 0 0 0 0
5 7 1 0 0 0 0
5 9 1 1 0 0 0
5 28 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 29 1 0 0 0 0
7 30 1 0 0 0 0
7 31 1 0 0 0 0
8 32 1 0 0 0 0
8 33 1 0 0 0 0
10 12 1 0 0 0 0
10 36 1 0 0 0 0
10 37 1 0 0 0 0
11 13 1 0 0 0 0
11 38 1 0 0 0 0
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12 13 1 0 0 0 0
12 15 2 0 0 0 0
13 16 2 0 0 0 0
14 17 2 0 0 0 0
14 18 1 0 0 0 0
15 19 1 0 0 0 0
15 40 1 0 0 0 0
16 20 1 0 0 0 0
16 41 1 0 0 0 0
17 21 1 0 0 0 0
17 42 1 0 0 0 0
18 23 2 0 0 0 0
18 43 1 0 0 0 0
19 20 2 0 0 0 0
19 44 1 0 0 0 0
20 45 1 0 0 0 0
21 22 1 0 0 0 0
21 24 2 0 0 0 0
22 23 1 0 0 0 0
22 25 2 0 0 0 0
23 46 1 0 0 0 0
24 26 1 0 0 0 0
24 47 1 0 0 0 0
25 27 1 0 0 0 0
25 48 1 0 0 0 0
26 27 2 0 0 0 0
26 49 1 0 0 0 0
27 50 1 0 0 0 0
M END
$$$$