BQRY78
-OEChem-04022115323D
28 28 0 1 0 0 0 0 0999 V2000
-1.7160 -0.1278 0.3502 P 0 0 1 0 0 0 0 0 0 0 0 0
-0.5342 -1.0638 0.9346 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5454 -0.2095 -1.2566 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0879 -0.4934 0.8380 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0279 0.8166 -1.2824 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1455 1.9857 0.3216 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2441 1.5448 0.7572 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2550 1.2043 1.0247 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5867 -0.1205 0.3701 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7309 -1.1633 0.3862 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9500 -0.1659 -0.2698 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0199 -2.5409 -0.1281 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5884 0.3336 -2.0457 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2448 1.9057 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2564 3.0473 0.5746 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3356 1.6653 1.8432 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9803 2.2246 0.3142 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0044 1.0395 2.0806 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1545 1.8336 1.0425 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1775 -1.1293 -0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7217 0.0351 0.4814 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0709 -2.8200 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7397 -2.6167 -1.1832 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4415 -3.2863 0.4292 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3089 0.2490 -3.0988 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7406 1.3885 -1.8048 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5131 -0.2251 -1.8798 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9279 0.7827 -1.6489 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 1 0 0 0 0
1 4 2 0 0 0 0
1 7 1 0 0 0 0
2 10 1 0 0 0 0
3 13 1 0 0 0 0
5 11 1 0 0 0 0
5 28 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 14 1 0 0 0 0
6 15 1 0 0 0 0
7 16 1 0 0 0 0
7 17 1 0 0 0 0
8 9 1 0 0 0 0
8 18 1 0 0 0 0
8 19 1 0 0 0 0
9 10 2 0 0 0 0
9 11 1 0 0 0 0
10 12 1 0 0 0 0
11 20 1 0 0 0 0
11 21 1 0 0 0 0
12 22 1 0 0 0 0
12 23 1 0 0 0 0
12 24 1 0 0 0 0
13 25 1 0 0 0 0
13 26 1 0 0 0 0
13 27 1 0 0 0 0
M END
$$$$