B89PFN
-OEChem-04022107483D
57 59 0 1 0 0 0 0 0999 V2000
2.3344 3.0103 1.3623 Cl 0 0 0 0 0 0 0 0 0 0 0 0
0.8967 -2.2248 -2.0825 F 0 0 0 0 0 0 0 0 0 0 0 0
2.5023 -3.5196 -1.3830 F 0 0 0 0 0 0 0 0 0 0 0 0
2.9438 -1.8804 -2.7498 F 0 0 0 0 0 0 0 0 0 0 0 0
-9.3253 1.6071 -0.1136 F 0 0 0 0 0 0 0 0 0 0 0 0
1.9870 -0.0062 -0.8828 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6684 1.2500 2.4257 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2838 0.4366 1.0296 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2153 -0.6437 1.0985 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1666 -1.7650 0.4532 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.2518 -0.5730 0.0814 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.0736 -1.8613 -0.2577 N 0 0 0 0 0 0 0 0 0 0 0 0
5.2807 1.3567 -0.7853 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.0896 1.3629 0.8219 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4290 -1.3142 -0.4951 C 0 0 1 0 0 0 0 0 0 0 0 0
3.9344 -1.2412 -0.1809 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5776 -1.7269 0.7171 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1886 -2.2399 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2803 -1.5554 2.2441 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4289 0.7308 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6860 -2.0775 2.4586 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6622 -0.6627 0.6337 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1038 -0.8722 0.3416 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3767 1.6392 0.1795 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1029 0.0644 0.4481 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7596 -2.0383 -0.0966 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4702 2.6848 0.1109 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5339 -0.0217 0.0326 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4926 3.4924 -1.0208 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7933 1.0677 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5551 -0.5610 0.8148 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2728 2.1633 -1.8702 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4081 3.2334 -2.0349 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0743 1.6177 -0.8484 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8359 -0.0108 0.7654 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0955 1.0785 -0.0662 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3551 -2.2550 -0.1671 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4501 -0.7275 -0.9904 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8416 -2.7369 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7148 -1.0309 1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9534 -1.0236 3.1446 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6144 -2.4077 2.1066 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2207 -2.6415 0.1196 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0879 -0.0866 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7176 -2.7440 3.3261 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3894 -1.2568 2.6342 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0403 -2.6368 1.5866 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3484 -3.0146 -0.3092 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2276 1.8294 1.0874 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9246 1.9353 0.8881 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8036 4.3260 -1.1273 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0145 1.4956 -1.4255 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3698 -1.4072 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0051 1.9185 -2.6323 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4435 3.8492 -2.9262 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2774 2.4643 -1.4976 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6311 -0.4295 1.3751 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
2 18 1 0 0 0 0
3 18 1 0 0 0 0
4 18 1 0 0 0 0
5 36 1 0 0 0 0
6 15 1 0 0 0 0
6 44 1 0 0 0 0
7 20 2 0 0 0 0
8 22 2 0 0 0 0
9 16 1 0 0 0 0
9 19 1 0 0 0 0
9 20 1 0 0 0 0
10 17 1 0 0 0 0
10 22 1 0 0 0 0
10 43 1 0 0 0 0
11 12 1 0 0 0 0
11 25 1 0 0 0 0
11 28 1 0 0 0 0
12 26 2 0 0 0 0
13 24 1 0 0 0 0
13 32 2 0 0 0 0
14 25 1 0 0 0 0
14 49 1 0 0 0 0
14 50 1 0 0 0 0
15 16 1 0 0 0 0
15 17 1 0 0 0 0
15 18 1 0 0 0 0
16 37 1 0 0 0 0
16 38 1 0 0 0 0
17 39 1 0 0 0 0
17 40 1 0 0 0 0
19 21 1 0 0 0 0
19 41 1 0 0 0 0
19 42 1 0 0 0 0
20 24 1 0 0 0 0
21 45 1 0 0 0 0
21 46 1 0 0 0 0
21 47 1 0 0 0 0
22 23 1 0 0 0 0
23 25 2 0 0 0 0
23 26 1 0 0 0 0
24 27 2 0 0 0 0
26 48 1 0 0 0 0
27 29 1 0 0 0 0
28 30 2 0 0 0 0
28 31 1 0 0 0 0
29 33 2 0 0 0 0
29 51 1 0 0 0 0
30 34 1 0 0 0 0
30 52 1 0 0 0 0
31 35 2 0 0 0 0
31 53 1 0 0 0 0
32 33 1 0 0 0 0
32 54 1 0 0 0 0
33 55 1 0 0 0 0
34 36 2 0 0 0 0
34 56 1 0 0 0 0
35 36 1 0 0 0 0
35 57 1 0 0 0 0
M END
$$$$