BL2KA0
-OEChem-04022114113D
35 36 0 0 0 0 0 0 0999 V2000
-3.1756 1.9865 0.2030 S 0 0 0 0 0 0 0 0 0 0 0 0
4.8605 0.7950 -1.0453 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5729 3.2171 -0.4553 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0976 1.2864 1.0752 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1436 -0.1014 -0.6656 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5214 0.9244 -0.9829 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8528 -3.1004 0.1163 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.2795 -0.4351 -0.6102 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9846 -0.9189 -0.4602 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4399 -0.1049 -0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3614 -1.2824 -0.3974 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8265 -2.2472 -0.0989 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5223 0.3519 -0.8616 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6393 -0.5646 1.1921 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8043 0.3493 -0.3117 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7089 2.3530 1.1404 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0968 -2.5944 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9212 -0.5677 1.7419 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0037 -0.1106 0.9902 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1433 0.7642 -0.4212 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0097 0.6160 -1.3713 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8127 1.3343 -1.6038 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3858 -0.9465 -0.5178 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1518 -2.7034 0.0154 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3735 0.7109 -1.8773 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8117 -0.9047 1.8086 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9722 3.0958 1.8969 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3553 1.4440 1.6293 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9507 2.7634 0.4708 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9056 -3.2964 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0749 -0.9211 2.7575 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9714 -0.1393 1.4792 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8651 1.1531 -1.1469 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4503 -0.2598 -0.1826 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1817 1.4235 0.4526 H 0 0 0 0 0 0 0 0 0 0 0 0
1 3 2 0 0 0 0
1 4 2 0 0 0 0
1 6 1 0 0 0 0
1 16 1 0 0 0 0
2 15 1 0 0 0 0
2 20 1 0 0 0 0
5 9 1 0 0 0 0
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5 21 1 0 0 0 0
6 8 1 0 0 0 0
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7 12 2 0 0 0 0
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8 11 1 0 0 0 0
9 12 1 0 0 0 0
10 13 2 0 0 0 0
10 14 1 0 0 0 0
11 17 2 0 0 0 0
11 23 1 0 0 0 0
12 24 1 0 0 0 0
13 15 1 0 0 0 0
13 25 1 0 0 0 0
14 18 2 0 0 0 0
14 26 1 0 0 0 0
15 19 2 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
16 29 1 0 0 0 0
17 30 1 0 0 0 0
18 19 1 0 0 0 0
18 31 1 0 0 0 0
19 32 1 0 0 0 0
20 33 1 0 0 0 0
20 34 1 0 0 0 0
20 35 1 0 0 0 0
M END
$$$$