D0Y6MH
-OEChem-10101305032D
46 49 0 1 0 0 0 0 0999 V2000
7.6567 -0.9909 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.9571 2.8794 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
3.4040 -2.2036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4375 -0.0350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3561 -2.9589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7088 -3.4941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1179 -1.4909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.8638 1.0998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.3584 2.0704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.1179 -0.4909 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.1096 -0.4868 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.0690 -0.1819 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.1096 -1.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6567 -0.9909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 -1.7999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4040 0.2218 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.3780 0.7692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1567 -0.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8979 0.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1227 0.1339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6648 1.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3780 -2.7510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3638 1.9659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7002 3.5486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5663 3.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9866 0.3489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3240 -0.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6305 0.2565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9665 0.6611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9676 0.5776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5696 1.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7883 0.9607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5420 -0.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7374 1.4399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2990 0.6806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2831 -0.4649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7215 0.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2633 1.0255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8265 1.7857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0662 1.3489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.4043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5477 -3.5486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0647 4.0502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2395 3.9634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1559 2.8570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8185 3.6150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
1 18 1 0 0 0 0
2 23 1 0 0 0 0
2 24 1 0 0 0 0
3 13 2 0 0 0 0
16 4 1 6 0 0 0
4 41 1 0 0 0 0
5 22 1 0 0 0 0
5 42 1 0 0 0 0
6 22 2 0 0 0 0
7 10 1 0 0 0 0
7 13 1 0 0 0 0
7 15 1 0 0 0 0
8 19 1 0 0 0 0
8 20 1 0 0 0 0
8 23 1 0 0 0 0
9 23 2 0 0 0 0
9 25 1 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 26 1 6 0 0 0
11 13 1 0 0 0 0
11 16 1 0 0 0 0
11 27 1 1 0 0 0
12 14 1 0 0 0 0
12 17 1 1 0 0 0
12 28 1 0 0 0 0
14 15 2 0 0 0 0
15 22 1 0 0 0 0
16 21 1 0 0 0 0
16 29 1 0 0 0 0
17 30 1 0 0 0 0
17 31 1 0 0 0 0
17 32 1 0 0 0 0
18 19 1 0 0 0 0
18 20 1 0 0 0 0
18 33 1 0 0 0 0
19 34 1 0 0 0 0
19 35 1 0 0 0 0
20 36 1 0 0 0 0
20 37 1 0 0 0 0
21 38 1 0 0 0 0
21 39 1 0 0 0 0
21 40 1 0 0 0 0
24 25 1 0 0 0 0
24 43 1 0 0 0 0
24 44 1 0 0 0 0
25 45 1 0 0 0 0
25 46 1 0 0 0 0
M END
$$$$