BP8K9Z
-OEChem-04022103193D
27 29 0 0 0 0 0 0 0999 V2000
-4.1863 1.4494 0.0008 F 0 0 0 0 0 0 0 0 0 0 0 0
2.2445 2.5343 0.0014 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7888 -1.5885 -1.0961 O 0 5 0 0 0 0 0 0 0 0 0 0
-3.7884 -1.5851 1.0991 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7141 0.7928 0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0
3.0732 -1.4547 0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.3764 -1.1515 0.0008 N 0 3 0 0 0 0 0 0 0 0 0 0
5.3443 -0.8764 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0630 0.6700 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3280 0.3148 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0152 -0.3855 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7301 -1.0373 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3942 -0.1142 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5923 -1.7185 -0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5947 1.9879 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7597 -2.0392 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4332 1.3245 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8704 1.1917 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9700 2.2433 -0.0011 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0125 -0.5577 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2907 -2.5521 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0450 2.8632 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0542 -3.0865 -0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3299 3.2680 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4909 1.4475 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6530 -1.8424 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0604 -0.1583 -0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
2 17 2 0 0 0 0
3 7 1 0 0 0 0
4 7 2 0 0 0 0
5 17 1 0 0 0 0
5 20 1 0 0 0 0
5 25 1 0 0 0 0
6 12 1 0 0 0 0
6 20 2 0 0 0 0
7 13 1 0 0 0 0
8 20 1 0 0 0 0
8 26 1 0 0 0 0
8 27 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
9 15 1 0 0 0 0
10 12 2 0 0 0 0
10 17 1 0 0 0 0
11 13 1 0 0 0 0
11 14 1 0 0 0 0
12 16 1 0 0 0 0
13 18 2 0 0 0 0
14 16 2 0 0 0 0
14 21 1 0 0 0 0
15 19 2 0 0 0 0
15 22 1 0 0 0 0
16 23 1 0 0 0 0
18 19 1 0 0 0 0
19 24 1 0 0 0 0
M CHG 2 3 -1 7 1
M END
$$$$