D0F3XT
-OEChem-10101305022D
30 31 0 1 0 0 0 0 0999 V2000
7.7953 1.6834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.5312 0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.6592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0290 -1.3755 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0290 0.6939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.3408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.1592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.3408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.7991 0.6834 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.9350 0.1800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9350 -0.8616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6671 0.1867 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
5.1350 -0.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.1592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6709 -0.8133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.6592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2610 0.9913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1441 -1.4453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5459 -0.7555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6647 0.8067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0218 -1.9954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0509 -0.8157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6733 -1.4333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2909 -0.8109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3310 1.9954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0693 0.3821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.9608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 27 1 0 0 0 0
2 12 1 0 0 0 0
2 28 1 0 0 0 0
3 16 2 0 0 0 0
4 11 1 0 0 0 0
4 13 1 0 0 0 0
4 22 1 0 0 0 0
5 10 2 0 0 0 0
5 14 1 0 0 0 0
6 13 1 0 0 0 0
6 17 1 0 0 0 0
6 26 1 0 0 0 0
7 16 1 0 0 0 0
7 17 2 0 0 0 0
8 17 1 0 0 0 0
8 29 1 0 0 0 0
8 30 1 0 0 0 0
9 10 1 0 0 0 0
9 12 1 0 0 0 0
9 18 1 0 0 0 0
10 11 1 0 0 0 0
11 19 1 0 0 0 0
11 20 1 0 0 0 0
12 15 1 0 0 0 0
12 21 1 0 0 0 0
13 14 2 0 0 0 0
14 16 1 0 0 0 0
15 23 1 0 0 0 0
15 24 1 0 0 0 0
15 25 1 0 0 0 0
M END
$$$$