B45HNP
-OEChem-04022101413D
33 34 0 0 0 0 0 0 0999 V2000
-3.2403 -2.6301 0.7489 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1241 1.5855 1.0949 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4668 3.3697 0.2750 O 0 5 0 0 0 0 0 0 0 0 0 0
-1.4361 2.7936 -1.8431 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0009 1.5153 1.9033 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3129 0.4954 -0.0546 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6187 2.5202 -0.6337 N 0 3 0 0 0 0 0 0 0 0 0 0
-1.0645 0.2150 0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4386 -0.3015 -0.3603 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0121 1.1991 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4770 -1.0720 0.3465 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6821 -0.0345 0.2124 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8370 -1.3750 0.4101 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3723 0.8961 -0.2165 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2941 -1.3680 -1.2475 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7848 -0.3909 0.1285 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7809 -0.8338 -0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3929 -2.1676 -1.5622 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6364 -1.9004 -0.9894 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8658 1.0716 1.1438 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2191 -3.5878 1.0241 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5458 1.4584 0.1684 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7137 -1.8013 0.5926 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1228 1.6525 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3454 -1.5862 -1.7303 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8456 -0.6210 0.1768 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7600 -0.6610 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2818 -2.9949 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4914 -2.5243 -1.2331 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7190 -4.5316 1.2656 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6294 -3.3061 1.9031 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5935 -3.7751 0.1447 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2399 2.3288 1.7246 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 21 1 0 0 0 0
2 20 1 0 0 0 0
2 33 1 0 0 0 0
3 7 1 0 0 0 0
4 7 2 0 0 0 0
5 20 2 0 0 0 0
6 8 1 0 0 0 0
6 9 1 0 0 0 0
6 22 1 0 0 0 0
7 10 1 0 0 0 0
8 10 2 0 0 0 0
8 11 1 0 0 0 0
9 12 1 0 0 0 0
9 15 2 0 0 0 0
10 14 1 0 0 0 0
11 13 2 0 0 0 0
11 23 1 0 0 0 0
12 17 2 0 0 0 0
12 20 1 0 0 0 0
13 16 1 0 0 0 0
14 16 2 0 0 0 0
14 24 1 0 0 0 0
15 18 1 0 0 0 0
15 25 1 0 0 0 0
16 26 1 0 0 0 0
17 19 1 0 0 0 0
17 27 1 0 0 0 0
18 19 2 0 0 0 0
18 28 1 0 0 0 0
19 29 1 0 0 0 0
21 30 1 0 0 0 0
21 31 1 0 0 0 0
21 32 1 0 0 0 0
M CHG 2 3 -1 7 1
M END
$$$$