B7H9JQ
-OEChem-04012113323D
40 42 0 0 0 0 0 0 0999 V2000
4.5100 -1.8192 0.2844 S 0 0 0 0 0 0 0 0 0 0 0 0
-5.7296 -0.9841 -0.1185 F 0 0 0 0 0 0 0 0 0 0 0 0
-4.6970 -2.6006 -1.1305 F 0 0 0 0 0 0 0 0 0 0 0 0
-4.7586 -2.5455 1.0424 F 0 0 0 0 0 0 0 0 0 0 0 0
1.0044 5.4360 0.0056 F 0 0 0 0 0 0 0 0 0 0 0 0
5.0909 -1.1163 1.4211 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6628 -3.2646 0.1861 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2750 -0.5936 0.0404 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1642 -1.6012 0.0276 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0975 -1.1094 -1.1551 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8434 0.6471 -0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0897 -0.8827 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1061 1.8870 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8033 -1.4579 0.2128 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2008 0.4326 -0.0539 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3390 -0.9681 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9525 0.0112 0.7168 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5636 -2.0601 -0.4643 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3159 -0.2777 0.7744 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9270 -2.3492 -0.4067 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7962 2.5107 1.2042 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7032 2.4620 -1.2095 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5886 -1.7466 -0.0603 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0832 3.7097 1.2074 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0098 3.6609 -1.2064 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3199 4.2848 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9374 0.3347 -1.3776 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9783 1.1822 -0.0987 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6636 0.8380 1.3308 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0919 -2.7676 -0.9653 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9764 0.4132 1.2913 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2855 -3.2692 -0.8596 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1188 2.0878 2.1534 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9360 1.9878 -2.1599 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1490 -1.6904 -2.0009 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1548 4.1976 2.1479 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3242 4.1087 -2.1445 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9703 0.5374 -1.8447 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0281 0.8969 -0.4451 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7256 0.6757 -2.0548 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 2 0 0 0 0
1 7 2 0 0 0 0
1 10 1 0 0 0 0
1 14 1 0 0 0 0
2 23 1 0 0 0 0
3 23 1 0 0 0 0
4 23 1 0 0 0 0
5 26 1 0 0 0 0
8 9 1 0 0 0 0
8 11 1 0 0 0 0
8 12 1 0 0 0 0
9 16 2 0 0 0 0
10 27 1 0 0 0 0
10 35 1 0 0 0 0
11 13 1 0 0 0 0
11 15 2 0 0 0 0
12 17 2 0 0 0 0
12 18 1 0 0 0 0
13 21 2 0 0 0 0
13 22 1 0 0 0 0
14 19 2 0 0 0 0
14 20 1 0 0 0 0
15 16 1 0 0 0 0
15 28 1 0 0 0 0
16 23 1 0 0 0 0
17 19 1 0 0 0 0
17 29 1 0 0 0 0
18 20 2 0 0 0 0
18 30 1 0 0 0 0
19 31 1 0 0 0 0
20 32 1 0 0 0 0
21 24 1 0 0 0 0
21 33 1 0 0 0 0
22 25 2 0 0 0 0
22 34 1 0 0 0 0
24 26 2 0 0 0 0
24 36 1 0 0 0 0
25 26 1 0 0 0 0
25 37 1 0 0 0 0
27 38 1 0 0 0 0
27 39 1 0 0 0 0
27 40 1 0 0 0 0
M END
$$$$