BIR0E9
-OEChem-04042106033D
50 53 0 1 0 0 0 0 0999 V2000
-5.6105 1.4583 0.5031 F 0 0 0 0 0 0 0 0 0 0 0 0
-5.6559 0.5390 -1.4607 F 0 0 0 0 0 0 0 0 0 0 0 0
-7.0616 -0.1018 0.0693 F 0 0 0 0 0 0 0 0 0 0 0 0
2.7914 2.4674 1.1606 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0698 -2.4910 -2.0599 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0178 -2.0014 -1.2139 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1011 1.6965 -0.1886 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1141 0.5084 -0.0649 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0805 0.9341 1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.1612 2.3501 -0.3800 C 0 0 1 0 0 0 0 0 0 0 0 0
-0.8336 1.4199 -1.5502 C 0 0 2 0 0 0 0 0 0 0 0 0
-1.9645 1.4623 0.5691 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0056 0.4412 -1.6516 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8603 0.6634 -0.3863 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1933 2.7845 0.1493 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4887 0.7672 -1.1376 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4236 -0.6001 0.2181 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3852 1.6176 0.3659 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8007 -0.7867 0.3373 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5449 -1.5890 0.6603 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2993 -1.9620 0.8989 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7609 0.2579 -0.1291 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0435 -2.7645 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4207 -2.9511 1.3413 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4295 0.1354 0.3058 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9705 -1.0152 -0.2448 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2628 -1.3691 0.1268 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3344 0.5581 1.5187 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2431 -1.8568 -1.1851 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9647 -0.5728 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7700 3.2064 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6941 1.9859 -2.4786 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5533 2.0557 1.2772 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3049 0.8187 1.1627 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6595 -0.5902 -1.7786 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6119 0.6706 -2.5369 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6555 1.3514 -0.6879 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2029 2.9819 1.2256 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5533 3.6776 -0.3737 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1462 0.6204 -2.0003 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3564 -0.1937 -0.6294 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4688 -1.4686 0.5748 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6539 -0.1147 -0.7179 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3677 -2.1296 1.0021 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3595 -3.5350 1.5657 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8086 -3.8665 1.7784 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7449 -2.2648 -0.2556 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8385 1.2122 2.2226 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9720 -0.8305 1.3315 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5719 -3.0554 -2.6891 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 1 0 0 0 0
2 22 1 0 0 0 0
3 22 1 0 0 0 0
4 18 2 0 0 0 0
5 29 1 0 0 0 0
5 50 1 0 0 0 0
6 29 2 0 0 0 0
7 15 1 0 0 0 0
7 16 1 0 0 0 0
7 18 1 0 0 0 0
8 18 1 0 0 0 0
8 25 1 0 0 0 0
8 43 1 0 0 0 0
9 25 1 0 0 0 0
9 28 2 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 15 1 0 0 0 0
10 31 1 0 0 0 0
11 13 1 0 0 0 0
11 16 1 0 0 0 0
11 32 1 0 0 0 0
12 14 1 0 0 0 0
12 33 1 0 0 0 0
12 34 1 0 0 0 0
13 14 1 0 0 0 0
13 35 1 0 0 0 0
13 36 1 0 0 0 0
14 17 1 0 0 0 0
14 37 1 0 0 0 0
15 38 1 0 0 0 0
15 39 1 0 0 0 0
16 40 1 0 0 0 0
16 41 1 0 0 0 0
17 19 1 0 0 0 0
17 20 2 0 0 0 0
19 21 2 0 0 0 0
19 22 1 0 0 0 0
20 23 1 0 0 0 0
20 42 1 0 0 0 0
21 24 1 0 0 0 0
21 44 1 0 0 0 0
23 24 2 0 0 0 0
23 45 1 0 0 0 0
24 46 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
26 29 1 0 0 0 0
27 30 2 0 0 0 0
27 47 1 0 0 0 0
28 30 1 0 0 0 0
28 48 1 0 0 0 0
30 49 1 0 0 0 0
M END
$$$$