D0V7RM
-OEChem-10101305022D
42 43 0 1 0 0 0 0 0999 V2000
9.5312 1.3154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -0.7088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.2088 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.8671 -0.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7610 1.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6671 0.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7610 -0.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2632 1.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3991 0.8187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6671 -0.2296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1311 0.8254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.9952 1.3288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8705 -1.1837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6675 -1.1837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.8288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.3288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.1012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7538 1.9459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0230 0.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7830 0.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7538 -1.3634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.6599 1.7986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8628 1.7955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0024 0.3423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7995 0.3453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2028 -0.5416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.7345 0.3489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.5315 0.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.3988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.3288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.3073 0.7930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.5310 1.6408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6832 1.8645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 16 1 0 0 0 0
2 5 1 0 0 0 0
2 38 1 0 0 0 0
2 39 1 0 0 0 0
3 4 1 0 0 0 0
3 5 1 0 0 0 0
3 20 1 0 0 0 0
3 21 1 0 0 0 0
4 8 2 0 0 0 0
4 9 1 0 0 0 0
5 12 1 0 0 0 0
5 22 1 0 0 0 0
6 7 2 0 0 0 0
6 8 1 0 0 0 0
6 14 1 0 0 0 0
7 10 1 0 0 0 0
7 11 1 0 0 0 0
8 23 1 0 0 0 0
9 10 2 0 0 0 0
9 24 1 0 0 0 0
10 25 1 0 0 0 0
11 13 2 0 0 0 0
11 26 1 0 0 0 0
12 27 1 0 0 0 0
12 28 1 0 0 0 0
12 29 1 0 0 0 0
13 17 1 0 0 0 0
14 17 2 0 0 0 0
14 30 1 0 0 0 0
15 16 1 0 0 0 0
15 18 1 0 0 0 0
15 31 1 0 0 0 0
15 32 1 0 0 0 0
16 33 1 0 0 0 0
16 34 1 0 0 0 0
17 35 1 0 0 0 0
18 19 1 0 0 0 0
18 36 1 0 0 0 0
18 37 1 0 0 0 0
19 40 1 0 0 0 0
19 41 1 0 0 0 0
19 42 1 0 0 0 0
M END
$$$$