D02KSN
-OEChem-04152122483D
45 48 0 0 0 0 0 0 0999 V2000
1.1312 0.1195 -1.5041 N 0 0 0 0 0 0 0 0 0 0 0 0
3.4118 -1.1036 0.0603 N 0 0 0 0 0 0 0 0 0 0 0 0
0.8871 2.3163 -1.2886 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.1491 3.0932 0.7455 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6466 -0.9834 -0.4538 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5065 4.2425 0.4765 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3590 -0.2537 0.3975 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.2253 -4.7917 0.9409 N 0 0 0 0 0 0 0 0 0 0 0 0
1.7469 -1.1370 -1.8634 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0787 0.3038 -0.8962 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3464 -1.8872 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2072 1.6673 -0.7739 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9561 -0.7733 -0.5079 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6738 1.3557 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2966 2.4273 -0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9163 -1.2478 -1.4016 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8443 -1.3401 0.7617 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4669 1.9769 0.3595 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3756 3.8294 -0.1019 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2993 -0.4561 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7645 -2.2892 -1.0256 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6926 -2.3815 1.1376 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5484 0.0774 1.4476 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6526 -2.8563 0.2439 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4420 3.1285 1.3859 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0443 0.8873 2.5677 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5204 -3.9242 0.6286 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9928 -1.7544 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5279 -0.9226 -2.6029 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8450 -2.8059 -0.9965 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6109 -2.1555 0.0927 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6379 1.4965 -2.1897 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0160 -0.8165 -2.3948 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1087 -0.9759 1.4746 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8779 0.9909 0.5207 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6612 4.5742 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3860 -0.4319 1.8289 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5079 -2.6484 -1.7333 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5945 -2.8118 2.1314 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3322 3.6207 2.3555 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1278 3.6886 0.7453 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8094 2.1087 1.5244 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8726 0.3781 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2599 1.0712 3.3086 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4046 1.8563 2.2085 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 10 1 0 0 0 0
1 14 1 0 0 0 0
2 5 1 0 0 0 0
2 11 1 0 0 0 0
2 20 1 0 0 0 0
3 12 1 0 0 0 0
3 14 2 0 0 0 0
4 6 1 0 0 0 0
4 18 1 0 0 0 0
4 25 1 0 0 0 0
5 7 2 0 0 0 0
6 19 2 0 0 0 0
7 23 1 0 0 0 0
8 27 3 0 0 0 0
9 11 1 0 0 0 0
9 28 1 0 0 0 0
9 29 1 0 0 0 0
10 12 2 0 0 0 0
10 13 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
12 15 1 0 0 0 0
13 16 2 0 0 0 0
13 17 1 0 0 0 0
14 32 1 0 0 0 0
15 18 2 0 0 0 0
15 19 1 0 0 0 0
16 21 1 0 0 0 0
16 33 1 0 0 0 0
17 22 2 0 0 0 0
17 34 1 0 0 0 0
18 35 1 0 0 0 0
19 36 1 0 0 0 0
20 23 2 0 0 0 0
20 37 1 0 0 0 0
21 24 2 0 0 0 0
21 38 1 0 0 0 0
22 24 1 0 0 0 0
22 39 1 0 0 0 0
23 26 1 0 0 0 0
24 27 1 0 0 0 0
25 40 1 0 0 0 0
25 41 1 0 0 0 0
25 42 1 0 0 0 0
26 43 1 0 0 0 0
26 44 1 0 0 0 0
26 45 1 0 0 0 0
M END
$$$$