D06ZPI
-OEChem-10101305032D
49 53 0 1 0 0 0 0 0999 V2000
2.2314 -0.2572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1561 -2.0271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.7122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.0922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1607 -1.2611 0.0000 N 0 3 1 0 0 0 0 0 0 0 0 0
3.6897 -0.7855 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5133 -1.2611 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.3370 -0.7855 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.2392 -0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2611 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.5918 -0.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6897 0.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5133 -2.2122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3370 0.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5133 0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6897 -2.6877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1166 -1.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.2122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.6411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3845 -2.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5133 1.5922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.5922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8487 -0.8734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6897 2.0677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8047 -1.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6284 -1.5840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3760 0.5166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6795 0.1787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0496 -1.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1840 0.0957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4989 0.5249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7254 -2.7948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1239 -2.1045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9476 0.0579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5490 0.7481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2912 -3.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0882 -3.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8345 -2.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6114 -1.9282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7802 -2.3745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5233 -2.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9888 -2.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2638 -2.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0503 1.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7100 -0.2691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6897 2.6877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9435 -1.7711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2586 -0.7445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 19 1 0 0 0 0
7 2 1 1 0 0 0
2 43 1 0 0 0 0
3 18 2 0 0 0 0
4 22 1 0 0 0 0
4 47 1 0 0 0 0
5 8 1 0 0 0 0
5 11 1 0 0 0 0
5 17 1 0 0 0 0
5 20 1 6 0 0 0
6 7 1 0 0 0 0
6 9 1 1 0 0 0
6 10 1 0 0 0 0
6 12 1 0 0 0 0
7 8 1 0 0 0 0
7 13 1 0 0 0 0
8 14 1 0 0 0 0
8 26 1 6 0 0 0
9 11 1 0 0 0 0
9 27 1 0 0 0 0
9 28 1 0 0 0 0
10 18 1 0 0 0 0
10 29 1 1 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 15 2 0 0 0 0
12 19 1 0 0 0 0
13 16 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 15 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 21 1 0 0 0 0
16 18 1 0 0 0 0
16 36 1 0 0 0 0
16 37 1 0 0 0 0
17 23 1 0 0 0 0
17 38 1 0 0 0 0
17 39 1 0 0 0 0
19 22 2 0 0 0 0
20 40 1 0 0 0 0
20 41 1 0 0 0 0
20 42 1 0 0 0 0
21 24 2 0 0 0 0
21 44 1 0 0 0 0
22 24 1 0 0 0 0
23 25 2 0 0 0 0
23 45 1 0 0 0 0
24 46 1 0 0 0 0
25 48 1 0 0 0 0
25 49 1 0 0 0 0
M CHG 1 5 1
M END
$$$$