BB6PT0
-OEChem-04012119052D
35 38 0 0 0 0 0 0 0999 V2000
4.5274 1.7426 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.3518 1.3870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.7328 -0.3723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3923 -1.5284 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3424 -0.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0274 0.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3219 -0.3723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.6183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7029 1.3870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7183 1.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0274 0.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3364 1.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7123 -0.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0547 0.6183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0321 0.8300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7040 0.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3374 1.7823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6814 0.3011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3148 1.9940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9867 1.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1160 -1.1582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8724 -0.9028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7081 -0.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3034 -0.9920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6208 1.1089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4518 0.3287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9426 1.9588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1806 1.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8018 -1.9940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7844 -1.6503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5147 -0.5009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9208 2.2414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0980 -0.1580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5041 2.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5927 1.3846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 12 1 0 0 0 0
2 12 2 0 0 0 0
2 14 1 0 0 0 0
3 13 1 0 0 0 0
3 14 2 0 0 0 0
4 13 1 0 0 0 0
4 29 1 0 0 0 0
4 30 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 21 1 0 0 0 0
5 22 1 0 0 0 0
6 10 2 0 0 0 0
6 11 1 0 0 0 0
7 8 1 0 0 0 0
7 23 1 0 0 0 0
7 24 1 0 0 0 0
8 9 1 0 0 0 0
8 25 1 0 0 0 0
8 26 1 0 0 0 0
9 10 1 0 0 0 0
9 27 1 0 0 0 0
9 28 1 0 0 0 0
11 12 1 0 0 0 0
11 13 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
15 17 1 0 0 0 0
16 18 1 0 0 0 0
16 31 1 0 0 0 0
17 19 2 0 0 0 0
17 32 1 0 0 0 0
18 20 2 0 0 0 0
18 33 1 0 0 0 0
19 20 1 0 0 0 0
19 34 1 0 0 0 0
20 35 1 0 0 0 0
M END
$$$$