D0S3RP
-OEChem-04152111033D
39 41 0 0 0 0 0 0 0999 V2000
5.0986 -1.2992 -0.1327 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.5030 0.4737 0.0536 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9605 -2.2475 -0.2133 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3220 0.2409 0.0111 N 0 0 0 0 0 0 0 0 0 0 0 0
2.2524 -1.8801 -0.1814 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8679 -0.0656 -0.0135 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0782 -1.2053 -0.1167 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9176 0.0906 0.0049 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1920 -0.5521 -0.0599 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3178 -1.1676 -0.1113 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2507 1.1911 0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1486 1.2510 0.1102 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3622 0.1891 0.0159 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6131 1.0436 0.1111 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0955 0.6777 0.0766 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.1518 -0.0269 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9876 1.3309 -0.4851 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1285 -0.8574 0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0004 1.8939 0.2163 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3791 1.4264 -0.4727 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5200 -0.7621 0.5415 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1452 0.3797 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8755 -2.0904 -0.2255 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8358 2.1013 0.1927 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5944 2.2349 0.2349 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7460 -3.2328 -0.3031 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3869 1.7434 -0.7026 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3790 1.5465 1.0572 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1353 1.2366 0.1046 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3195 -0.0306 0.8832 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3268 0.1643 -0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4354 2.1571 -0.9243 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6860 -1.7519 0.9588 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8279 2.6047 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8202 2.4077 1.1659 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0515 1.5902 0.1869 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8614 2.3152 -0.8704 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1059 -1.5809 0.9506 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.8712 -0.3383 0.4425 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 2 0 0 0 0
2 22 1 0 0 0 0
2 39 1 0 0 0 0
3 5 1 0 0 0 0
3 7 1 0 0 0 0
3 26 1 0 0 0 0
4 9 1 0 0 0 0
4 16 1 0 0 0 0
4 29 1 0 0 0 0
5 9 2 0 0 0 0
6 7 2 0 0 0 0
6 9 1 0 0 0 0
6 11 1 0 0 0 0
7 10 1 0 0 0 0
8 10 2 0 0 0 0
8 12 1 0 0 0 0
8 13 1 0 0 0 0
10 23 1 0 0 0 0
11 12 2 0 0 0 0
11 24 1 0 0 0 0
12 25 1 0 0 0 0
13 17 2 0 0 0 0
13 18 1 0 0 0 0
14 15 1 0 0 0 0
14 16 1 0 0 0 0
14 27 1 0 0 0 0
14 28 1 0 0 0 0
15 19 1 0 0 0 0
15 30 1 0 0 0 0
15 31 1 0 0 0 0
17 20 1 0 0 0 0
17 32 1 0 0 0 0
18 21 2 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
19 36 1 0 0 0 0
20 22 2 0 0 0 0
20 37 1 0 0 0 0
21 22 1 0 0 0 0
21 38 1 0 0 0 0
M END
$$$$