B0RUN3
-OEChem-04042102313D
35 37 0 0 0 0 0 0 0999 V2000
1.1858 -3.2593 -0.3502 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9655 -2.0669 1.1743 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9777 -0.4770 -0.9821 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.9585 -3.0419 0.5240 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0010 -1.1712 -0.3562 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2166 -0.8183 0.0917 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8427 0.5028 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1877 -2.6140 -0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0302 0.2212 -0.3053 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8574 -2.0261 0.6674 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0392 -0.4492 -2.4552 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6191 0.8466 -1.0878 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6632 1.4180 1.0563 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0734 0.2012 1.0777 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9785 0.8994 -1.0509 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2155 2.1057 -1.1574 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2597 2.6770 0.9866 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0975 0.8815 1.7364 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0027 1.5795 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0359 3.0207 -0.1203 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0622 1.5705 1.0016 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1200 -3.9941 0.8317 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9588 -0.9144 -2.8283 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9322 0.5709 -2.8414 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2088 -1.0251 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7679 0.1443 -1.9044 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0626 1.1647 1.9265 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3444 -0.3250 1.6858 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9895 0.9485 -2.1336 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8197 2.3736 -2.0193 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1200 3.3896 1.7943 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1445 0.8743 2.8216 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7543 2.1170 -0.9631 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5003 4.0010 -0.1744 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8596 2.1001 1.5145 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 2 0 0 0 0
2 10 2 0 0 0 0
3 5 1 0 0 0 0
3 9 1 0 0 0 0
3 11 1 0 0 0 0
4 8 1 0 0 0 0
4 10 1 0 0 0 0
4 22 1 0 0 0 0
5 6 2 0 0 0 0
5 8 1 0 0 0 0
6 7 1 0 0 0 0
6 10 1 0 0 0 0
7 12 2 0 0 0 0
7 13 1 0 0 0 0
9 14 2 0 0 0 0
9 15 1 0 0 0 0
11 23 1 0 0 0 0
11 24 1 0 0 0 0
11 25 1 0 0 0 0
12 16 1 0 0 0 0
12 26 1 0 0 0 0
13 17 2 0 0 0 0
13 27 1 0 0 0 0
14 18 1 0 0 0 0
14 28 1 0 0 0 0
15 19 2 0 0 0 0
15 29 1 0 0 0 0
16 20 2 0 0 0 0
16 30 1 0 0 0 0
17 20 1 0 0 0 0
17 31 1 0 0 0 0
18 21 2 0 0 0 0
18 32 1 0 0 0 0
19 21 1 0 0 0 0
19 33 1 0 0 0 0
20 34 1 0 0 0 0
21 35 1 0 0 0 0
M END
$$$$