D0D1PR
-OEChem-10101305022D
47 50 0 1 0 0 0 0 0999 V2000
6.9464 3.2846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3198 1.7499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5381 0.7395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7925 -1.2816 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
6.9343 -0.7847 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.9343 0.2153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0682 -1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6580 -0.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8443 0.7222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6836 0.1940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0682 0.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2022 -0.7847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7851 -2.2816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2022 0.2153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8523 1.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0522 1.7568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6474 -2.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9502 2.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3083 -1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3083 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4022 0.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4022 -0.8055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6400 -3.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8105 3.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9337 -1.6347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6697 -1.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4668 -1.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8597 -1.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2708 -0.7031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2907 0.0681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9154 0.7690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1753 -2.1694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5687 -2.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3904 2.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5117 2.0606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2572 -2.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8638 -2.2069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3154 -1.9393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8665 -1.1175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0200 -3.7833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6354 -4.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2600 -3.7925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7865 2.0661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.4316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1225 3.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3462 4.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4984 4.3237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
1 24 1 0 0 0 0
2 20 1 0 0 0 0
2 43 1 0 0 0 0
3 21 1 0 0 0 0
3 44 1 0 0 0 0
4 5 1 0 0 0 0
4 8 1 0 0 0 0
4 13 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 25 1 1 0 0 0
6 9 2 0 0 0 0
6 11 1 0 0 0 0
7 12 1 0 0 0 0
7 26 1 0 0 0 0
7 27 1 0 0 0 0
8 10 1 0 0 0 0
8 28 1 0 0 0 0
8 29 1 0 0 0 0
9 10 1 0 0 0 0
9 15 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 14 1 0 0 0 0
11 16 2 0 0 0 0
12 14 2 0 0 0 0
12 19 1 0 0 0 0
13 17 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 20 1 0 0 0 0
15 18 2 0 0 0 0
15 34 1 0 0 0 0
16 18 1 0 0 0 0
16 35 1 0 0 0 0
17 23 1 0 0 0 0
17 36 1 0 0 0 0
17 37 1 0 0 0 0
19 22 2 0 0 0 0
19 38 1 0 0 0 0
20 21 2 0 0 0 0
21 22 1 0 0 0 0
22 39 1 0 0 0 0
23 40 1 0 0 0 0
23 41 1 0 0 0 0
23 42 1 0 0 0 0
24 45 1 0 0 0 0
24 46 1 0 0 0 0
24 47 1 0 0 0 0
M END
$$$$