D0T3CM
-OEChem-10101305022D
56 58 0 1 0 0 0 0 0999 V2000
3.0000 1.4151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0000 -0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 -2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7320 1.4151 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.7320 0.4151 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.8660 1.9151 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.0000 1.4151 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.8660 -0.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0000 0.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6260 1.9497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6260 -0.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 1.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7320 -0.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8660 2.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 2.2811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5321 1.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5321 0.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6144 -1.1195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5000 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5000 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5000 -2.9151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7255 2.2650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4030 2.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4675 -0.5599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2646 -0.5599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3894 0.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7880 -0.1675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0196 2.4287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2214 2.4195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1077 2.0256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4174 1.6271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1120 -0.5849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7320 -1.2049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3520 -0.5849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4860 2.9151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8660 3.5351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2460 2.9151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0369 2.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1900 2.8180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9631 1.9711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1429 1.3298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7411 2.0196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0678 0.0822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9945 -1.1124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6073 -1.7395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2344 -1.1267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1900 -1.7200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3800 1.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9631 -2.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1900 -3.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0369 -3.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 21 1 0 0 0 0
1 53 1 0 0 0 0
2 22 2 0 0 0 0
3 23 1 0 0 0 0
3 26 1 0 0 0 0
4 24 2 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 11 1 0 0 0 0
5 27 1 1 0 0 0
6 9 1 0 0 0 0
6 12 1 0 0 0 0
6 14 1 6 0 0 0
7 8 1 0 0 0 0
7 15 1 6 0 0 0
7 28 1 0 0 0 0
8 10 1 0 0 0 0
8 13 1 0 0 0 0
8 16 1 1 0 0 0
9 10 1 0 0 0 0
9 29 1 0 0 0 0
9 30 1 0 0 0 0
10 31 1 0 0 0 0
10 32 1 0 0 0 0
11 17 1 0 0 0 0
11 33 1 0 0 0 0
11 34 1 0 0 0 0
12 18 2 0 0 0 0
12 19 1 0 0 0 0
13 20 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 37 1 0 0 0 0
14 38 1 0 0 0 0
14 39 1 0 0 0 0
15 40 1 0 0 0 0
15 41 1 0 0 0 0
15 42 1 0 0 0 0
16 43 1 0 0 0 0
16 44 1 0 0 0 0
16 45 1 0 0 0 0
17 18 1 0 0 0 0
17 46 1 0 0 0 0
17 47 1 0 0 0 0
18 48 1 0 0 0 0
19 49 1 0 0 0 0
19 50 1 0 0 0 0
19 51 1 0 0 0 0
20 21 2 0 0 0 0
20 22 1 0 0 0 0
21 24 1 0 0 0 0
22 23 1 0 0 0 0
23 25 2 0 0 0 0
24 25 1 0 0 0 0
25 52 1 0 0 0 0
26 54 1 0 0 0 0
26 55 1 0 0 0 0
26 56 1 0 0 0 0
M END
$$$$