BWET24
-OEChem-04042104013D
41 42 0 1 0 0 0 0 0999 V2000
-5.7317 -1.4605 2.1825 F 0 0 0 0 0 0 0 0 0 0 0 0
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4.5648 -2.6479 0.6928 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2196 2.9536 0.4137 N 0 0 0 0 0 0 0 0 0 0 0 0
4.3587 -1.1853 0.5038 C 0 0 1 0 0 0 0 0 0 0 0 0
5.5780 -1.1891 -0.4405 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9873 -2.4586 0.3197 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0126 -0.8546 -0.1088 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6601 1.1005 -0.1665 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4393 2.3770 0.3253 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5583 0.3687 -0.5953 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9359 -1.5288 -0.5776 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7127 0.9278 -0.5202 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5075 -0.3062 0.1489 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0261 -1.1528 -1.7485 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5889 3.2047 0.7987 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8273 2.2120 -0.0124 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4298 -0.7157 1.2851 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8655 0.2002 -0.9533 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8365 -0.4092 -1.3118 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5333 -0.6271 1.4345 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2572 -0.3376 -0.3538 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3459 -1.3615 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4147 -3.2601 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6418 -2.2799 1.1807 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0522 -3.2215 0.0219 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2340 -1.2447 0.5605 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8984 -1.3147 -1.0978 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6637 -0.6274 -1.0172 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3796 -2.1515 0.1346 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7620 -2.1415 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6912 0.2922 0.5682 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0573 0.3263 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5883 -0.5569 -2.4769 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7119 -2.0685 -2.2627 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2980 3.3762 -0.0174 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1050 2.7050 1.6249 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2486 4.1816 1.1581 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7916 2.7048 0.0728 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2708 -1.3161 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8202 0.1626 1.8068 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
2 8 1 0 0 0 0
2 9 1 0 0 0 0
3 5 1 0 0 0 0
3 7 1 0 0 0 0
3 26 1 0 0 0 0
4 10 1 0 0 0 0
4 17 2 0 0 0 0
5 6 1 0 0 0 0
5 8 1 0 0 0 0
5 21 1 0 0 0 0
6 7 1 0 0 0 0
6 22 1 0 0 0 0
6 23 1 0 0 0 0
7 24 1 0 0 0 0
7 25 1 0 0 0 0
8 27 1 0 0 0 0
8 28 1 0 0 0 0
9 10 2 0 0 0 0
9 11 1 0 0 0 0
10 16 1 0 0 0 0
11 13 2 0 0 0 0
11 29 1 0 0 0 0
12 14 1 0 0 0 0
12 15 1 0 0 0 0
12 30 1 0 0 0 0
12 31 1 0 0 0 0
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16 36 1 0 0 0 0
16 37 1 0 0 0 0
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17 39 1 0 0 0 0
18 40 1 0 0 0 0
18 41 1 0 0 0 0
19 20 3 0 0 0 0
M END
$$$$