BI9RC5
-OEChem-04012114293D
44 49 0 1 0 0 0 0 0999 V2000
0.3695 0.4174 -2.0258 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0424 -1.5646 2.2334 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5209 1.0149 -1.7846 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0699 1.6347 -0.0444 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7887 2.9979 0.4984 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9013 1.9367 0.0368 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3854 -2.6528 -0.5864 N 0 0 2 0 0 0 0 0 0 0 0 0
-0.1879 -1.2237 -0.2073 C 0 0 1 0 0 0 0 0 0 0 0 0
0.8931 -0.5959 -1.1798 C 0 0 2 0 0 0 0 0 0 0 0 0
-1.4925 -0.4012 -0.1491 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4814 -1.1411 1.1779 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9615 -0.0861 -0.2596 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6348 -3.2321 -0.0905 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7481 -1.0191 -0.3818 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7459 -0.4212 1.0739 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8184 -2.4868 -0.6921 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4651 0.9722 0.1768 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7346 -3.5545 -0.3014 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1087 0.6047 -0.5574 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9379 -0.2711 -0.3497 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6224 -0.0814 2.1025 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6532 1.6738 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8562 1.0700 -0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9937 0.9546 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7794 0.6286 1.7735 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7633 1.6678 -1.4537 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2172 3.1582 0.3829 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3387 -1.3505 -1.8376 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6765 -3.2123 1.0059 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7170 -4.2830 -0.3954 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7433 -2.9139 -0.2861 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8418 -2.6174 -1.7812 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5334 1.4858 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5754 -4.5169 -0.8018 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8496 -3.7547 0.7695 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6864 -3.1748 -0.6838 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8980 -0.7371 -0.5468 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4187 -0.3546 3.1321 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1113 0.9355 -2.3808 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4898 0.9139 2.5417 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7065 2.7139 -1.7756 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5752 1.1749 -2.0008 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4252 3.9081 -0.3891 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6085 3.5206 1.3405 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 39 1 0 0 0 0
2 11 2 0 0 0 0
3 19 1 0 0 0 0
3 26 1 0 0 0 0
4 24 1 0 0 0 0
4 26 1 0 0 0 0
5 22 1 0 0 0 0
5 27 1 0 0 0 0
6 23 1 0 0 0 0
6 27 1 0 0 0 0
7 8 1 0 0 0 0
7 13 1 0 0 0 0
7 18 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 11 1 0 0 0 0
9 12 1 0 0 0 0
9 28 1 0 0 0 0
10 14 1 0 0 0 0
10 17 2 0 0 0 0
11 15 1 0 0 0 0
12 15 2 0 0 0 0
12 19 1 0 0 0 0
13 16 1 0 0 0 0
13 29 1 0 0 0 0
13 30 1 0 0 0 0
14 16 1 0 0 0 0
14 20 2 0 0 0 0
15 21 1 0 0 0 0
16 31 1 0 0 0 0
16 32 1 0 0 0 0
17 22 1 0 0 0 0
17 33 1 0 0 0 0
18 34 1 0 0 0 0
18 35 1 0 0 0 0
18 36 1 0 0 0 0
19 24 2 0 0 0 0
20 23 1 0 0 0 0
20 37 1 0 0 0 0
21 25 2 0 0 0 0
21 38 1 0 0 0 0
22 23 2 0 0 0 0
24 25 1 0 0 0 0
25 40 1 0 0 0 0
26 41 1 0 0 0 0
26 42 1 0 0 0 0
27 43 1 0 0 0 0
27 44 1 0 0 0 0
M END
$$$$