BT47FE
-OEChem-04042105483D
23 24 0 0 0 0 0 0 0999 V2000
0.6490 1.5940 -0.0007 S 0 0 0 0 0 0 0 0 0 0 0 0
3.8943 -0.5599 0.0149 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9880 1.2307 0.0016 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4572 -2.1990 -0.0037 N 0 0 0 0 0 0 0 0 0 0 0 0
3.5653 1.6855 -0.0041 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5053 -0.7169 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9057 -0.9604 -0.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7703 0.6487 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6433 0.2029 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6199 -1.5801 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0133 0.3522 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8963 -1.0265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0614 0.3779 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3832 0.9507 0.0029 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4966 -2.6591 -0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7692 -1.6711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8993 -3.0475 -0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4611 -2.3534 -0.0048 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3354 2.0448 0.0036 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9360 0.6384 -0.8888 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9347 0.6370 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9575 2.4983 -0.0102 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5652 1.8579 0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0
1 8 1 0 0 0 0
1 9 1 0 0 0 0
2 13 2 0 0 0 0
3 8 1 0 0 0 0
3 11 2 0 0 0 0
4 7 1 0 0 0 0
4 17 1 0 0 0 0
4 18 1 0 0 0 0
5 13 1 0 0 0 0
5 22 1 0 0 0 0
5 23 1 0 0 0 0
6 7 1 0 0 0 0
6 8 2 0 0 0 0
6 10 1 0 0 0 0
7 9 2 0 0 0 0
9 13 1 0 0 0 0
10 12 2 0 0 0 0
10 15 1 0 0 0 0
11 12 1 0 0 0 0
11 14 1 0 0 0 0
12 16 1 0 0 0 0
14 19 1 0 0 0 0
14 20 1 0 0 0 0
14 21 1 0 0 0 0
M END
$$$$