B05RNE
-OEChem-04042106083D
36 36 0 0 0 0 0 0 0999 V2000
0.4621 -2.5658 -1.5082 S 0 0 0 0 0 0 0 0 0 0 0 0
-2.0479 1.9602 -0.4497 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0957 0.0323 0.6848 N 0 0 0 0 0 0 0 0 0 0 0 0
1.9659 -0.4289 -1.1933 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1937 -0.1459 -0.3367 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9670 0.9531 0.5543 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4011 0.8993 -0.8572 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6174 0.0539 2.0509 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1488 0.3761 -0.2699 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7099 -0.9961 -0.9639 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5419 -0.3277 0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4306 0.7310 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9339 -1.5748 0.5218 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7528 0.5368 0.3982 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2561 -1.7688 0.9218 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1654 -0.7131 0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0457 2.9784 -0.4778 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2641 1.9836 0.7879 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1810 0.6725 1.2665 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1272 1.2089 -1.6156 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5876 1.6219 -0.9612 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6465 -1.0252 -1.6544 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4263 -0.6762 2.1667 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8371 -0.2302 2.7658 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0006 1.0415 2.3323 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8810 0.1103 -1.2968 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0551 -0.2061 -0.0609 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4233 1.4365 -0.2293 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0509 0.8370 -0.3434 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2481 -2.4015 0.6605 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5150 1.3080 0.3797 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5738 -2.7369 1.2981 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1936 -0.8645 1.1758 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4126 3.2131 0.5273 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8562 2.7315 -1.1721 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5676 3.8864 -0.8599 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 2 0 0 0 0
2 12 1 0 0 0 0
2 17 1 0 0 0 0
3 6 1 0 0 0 0
3 8 1 0 0 0 0
3 9 1 0 0 0 0
4 7 1 0 0 0 0
4 10 1 0 0 0 0
4 22 1 0 0 0 0
5 10 1 0 0 0 0
5 11 1 0 0 0 0
5 29 1 0 0 0 0
6 7 1 0 0 0 0
6 18 1 0 0 0 0
6 19 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 23 1 0 0 0 0
8 24 1 0 0 0 0
8 25 1 0 0 0 0
9 26 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
12 14 2 0 0 0 0
13 15 1 0 0 0 0
13 30 1 0 0 0 0
14 16 1 0 0 0 0
14 31 1 0 0 0 0
15 16 2 0 0 0 0
15 32 1 0 0 0 0
16 33 1 0 0 0 0
17 34 1 0 0 0 0
17 35 1 0 0 0 0
17 36 1 0 0 0 0
M END
$$$$