BB0QV9
-OEChem-04042103553D
32 33 0 0 0 0 0 0 0999 V2000
1.4207 1.0759 -1.0932 S 0 0 0 0 0 0 0 0 0 0 0 0
-4.8559 0.5503 1.1072 F 0 0 0 0 0 0 0 0 0 0 0 0
-5.0161 -0.7066 -0.6599 F 0 0 0 0 0 0 0 0 0 0 0 0
-4.2910 -1.5472 1.2032 F 0 0 0 0 0 0 0 0 0 0 0 0
1.7528 0.2979 -2.2785 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5330 2.5284 -1.1265 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5051 0.5621 0.2118 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1288 -0.6541 0.3107 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2129 0.6387 -0.6591 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9615 -1.7193 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8443 1.3408 1.2874 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8780 -0.6514 1.4665 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6981 0.6108 2.0843 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0082 1.5353 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7219 -0.6079 -1.0235 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7593 -2.9841 -0.3681 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8214 -0.0613 0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3124 1.1852 0.4041 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0261 -0.9579 -0.6741 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2159 -0.4356 0.4133 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9091 -2.0001 -0.7907 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3212 -1.3753 -1.6748 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4531 2.3420 1.4053 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4917 -1.4593 1.8401 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1407 0.9508 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6292 2.5082 0.3546 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1291 -1.3221 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8336 -2.7779 -0.3115 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6047 -3.7368 -1.1483 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4393 -3.4202 0.5844 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9148 1.8970 0.9616 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4147 -1.9306 -0.9637 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 2 0 0 0 0
1 6 2 0 0 0 0
1 7 1 0 0 0 0
1 9 1 0 0 0 0
2 20 1 0 0 0 0
3 20 1 0 0 0 0
4 20 1 0 0 0 0
7 8 1 0 0 0 0
7 11 1 0 0 0 0
8 10 1 0 0 0 0
8 12 2 0 0 0 0
9 14 2 0 0 0 0
9 15 1 0 0 0 0
10 16 1 0 0 0 0
10 21 1 0 0 0 0
10 22 1 0 0 0 0
11 13 2 0 0 0 0
11 23 1 0 0 0 0
12 13 1 0 0 0 0
12 24 1 0 0 0 0
13 25 1 0 0 0 0
14 18 1 0 0 0 0
14 26 1 0 0 0 0
15 19 2 0 0 0 0
15 27 1 0 0 0 0
16 28 1 0 0 0 0
16 29 1 0 0 0 0
16 30 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
17 20 1 0 0 0 0
18 31 1 0 0 0 0
19 32 1 0 0 0 0
M END
$$$$