BLQA14
-OEChem-04022103143D
25 27 0 0 0 0 0 0 0999 V2000
-2.7801 0.6586 -1.3984 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.3245 -1.6868 1.6766 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.1368 1.4135 -0.4318 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1252 1.1440 0.6725 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.8682 -0.1526 0.7675 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4979 -0.4674 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9015 -0.4811 -0.4199 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9104 0.7453 0.4121 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7658 -1.0637 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6624 -1.0317 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4915 0.7447 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9446 -0.5118 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6274 1.3414 0.8275 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2831 -0.7645 -0.6236 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6701 -0.8136 0.6874 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9329 0.2108 0.0326 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1490 0.7150 -0.2703 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7697 -1.9614 -1.4152 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6739 -1.9168 -1.3972 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4409 1.1973 0.7513 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6332 2.2363 1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7088 -1.5804 -1.1807 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0079 0.3090 0.0902 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5002 -0.3005 1.5464 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0571 -1.6795 2.3163 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 1 0 0 0 0
1 17 1 0 0 0 0
2 15 1 0 0 0 0
2 25 1 0 0 0 0
3 17 2 0 0 0 0
4 8 2 0 0 0 0
4 16 1 0 0 0 0
5 15 1 0 0 0 0
5 17 1 0 0 0 0
5 24 1 0 0 0 0
6 9 1 0 0 0 0
6 10 2 0 0 0 0
6 11 1 0 0 0 0
7 8 1 0 0 0 0
7 9 2 0 0 0 0
7 14 1 0 0 0 0
8 13 1 0 0 0 0
9 18 1 0 0 0 0
10 12 1 0 0 0 0
10 19 1 0 0 0 0
11 13 2 0 0 0 0
11 20 1 0 0 0 0
12 15 2 0 0 0 0
13 21 1 0 0 0 0
14 16 2 0 0 0 0
14 22 1 0 0 0 0
16 23 1 0 0 0 0
M END
$$$$