B6ONI5
-OEChem-04022112233D
31 31 0 0 0 0 0 0 0999 V2000
2.4554 -1.3351 -0.0003 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3162 -0.1635 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
-0.8404 0.2428 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9807 0.4032 -1.2514 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9771 0.3853 1.2613 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4976 -1.6800 -0.0098 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1528 -0.7365 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4889 1.5927 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4977 -0.3661 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8492 0.9839 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8558 1.9632 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2833 1.3990 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0069 -2.6891 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0186 0.0558 -1.2731 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9679 1.4959 -1.2118 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4413 0.0367 -2.1306 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0161 0.0408 1.2792 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4372 0.0037 2.1337 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9599 1.4785 1.2386 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5734 -1.8887 -0.0125 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0596 -2.0937 -0.9239 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0623 -2.1055 0.9001 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1288 -1.7776 0.0003 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2388 2.3781 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1130 3.0191 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7895 1.0171 0.8931 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7902 1.0157 -0.8915 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3942 2.4886 -0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9010 -3.3216 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4507 -2.9325 -0.9121 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4511 -2.9326 0.9118 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 13 1 0 0 0 0
2 3 1 0 0 0 0
2 4 1 0 0 0 0
2 5 1 0 0 0 0
2 6 1 0 0 0 0
3 7 2 0 0 0 0
3 8 1 0 0 0 0
4 14 1 0 0 0 0
4 15 1 0 0 0 0
4 16 1 0 0 0 0
5 17 1 0 0 0 0
5 18 1 0 0 0 0
5 19 1 0 0 0 0
6 20 1 0 0 0 0
6 21 1 0 0 0 0
6 22 1 0 0 0 0
7 9 1 0 0 0 0
7 23 1 0 0 0 0
8 11 2 0 0 0 0
8 24 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
11 25 1 0 0 0 0
12 26 1 0 0 0 0
12 27 1 0 0 0 0
12 28 1 0 0 0 0
13 29 1 0 0 0 0
13 30 1 0 0 0 0
13 31 1 0 0 0 0
M CHG 1 2 1
M END
$$$$