BGC84S
-OEChem-04022118533D
61 64 0 1 0 0 0 0 0999 V2000
0.9261 1.5894 1.2948 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6189 -1.0126 -2.1559 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2401 1.7991 -0.6790 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9095 0.1469 -0.1639 N 0 0 0 0 0 0 0 0 0 0 0 0
3.2884 1.9452 1.4333 C 0 0 2 0 0 0 0 0 0 0 0 0
4.4841 2.7626 0.9171 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5301 0.4424 1.2242 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8799 2.3832 -0.5107 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0823 0.8772 -0.6468 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9755 2.3892 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2658 -0.7645 -1.0002 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0638 -1.4731 -0.4289 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4709 -2.4304 -1.4526 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1292 1.3689 0.4586 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2711 -3.1869 -0.9367 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1574 0.5203 1.1121 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4425 -4.4149 -0.2976 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0093 -2.6580 -1.0992 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5116 0.6336 0.7977 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7377 -0.4094 2.0634 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9769 1.5907 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6666 -5.1139 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1182 -3.3569 -0.6226 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4461 -0.1829 1.4346 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9469 -4.5850 0.0164 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6721 -1.2260 2.7004 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0263 -1.1128 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3334 2.8801 0.2079 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0681 1.2221 -1.5291 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7811 3.8010 -0.7393 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5158 2.1429 -2.4764 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8723 3.4324 -2.0814 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1915 2.1113 2.5146 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3427 2.5855 1.5777 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2651 3.8354 0.9692 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3748 0.1213 1.8475 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6744 -0.1468 1.5549 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8021 2.9059 -0.7884 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1049 2.7154 -1.2111 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2968 0.6268 -1.6904 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9411 0.5499 -0.0489 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0432 2.3094 -0.3084 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7678 3.4349 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3159 -0.7328 -0.1504 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3666 -2.0293 0.4653 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1811 -1.8844 -2.3609 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2287 -3.1545 -1.7818 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4352 -4.8360 -0.1631 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1538 -1.7021 -1.5947 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3097 -0.5342 2.3233 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5331 -6.0696 0.6774 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1150 -2.9444 -0.7486 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5059 -0.1099 1.2017 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3451 -1.9534 3.4376 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8105 -5.1285 0.3883 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7535 -1.7503 2.8803 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2675 3.1838 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7964 0.2211 -1.8546 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0584 4.8050 -0.4319 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5870 1.8560 -3.5215 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2208 4.1494 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 1 0 0 0 0
1 14 1 0 0 0 0
2 11 2 0 0 0 0
3 14 2 0 0 0 0
4 7 1 0 0 0 0
4 9 1 0 0 0 0
4 11 1 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 10 1 0 0 0 0
5 33 1 0 0 0 0
6 8 1 0 0 0 0
6 34 1 0 0 0 0
6 35 1 0 0 0 0
7 36 1 0 0 0 0
7 37 1 0 0 0 0
8 9 1 0 0 0 0
8 38 1 0 0 0 0
8 39 1 0 0 0 0
9 40 1 0 0 0 0
9 41 1 0 0 0 0
10 42 1 0 0 0 0
10 43 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
12 44 1 0 0 0 0
12 45 1 0 0 0 0
13 15 1 0 0 0 0
13 46 1 0 0 0 0
13 47 1 0 0 0 0
14 16 1 0 0 0 0
15 17 2 0 0 0 0
15 18 1 0 0 0 0
16 19 1 0 0 0 0
16 20 2 0 0 0 0
17 22 1 0 0 0 0
17 48 1 0 0 0 0
18 23 2 0 0 0 0
18 49 1 0 0 0 0
19 21 1 0 0 0 0
19 24 2 0 0 0 0
20 26 1 0 0 0 0
20 50 1 0 0 0 0
21 28 2 0 0 0 0
21 29 1 0 0 0 0
22 25 2 0 0 0 0
22 51 1 0 0 0 0
23 25 1 0 0 0 0
23 52 1 0 0 0 0
24 27 1 0 0 0 0
24 53 1 0 0 0 0
25 55 1 0 0 0 0
26 27 2 0 0 0 0
26 54 1 0 0 0 0
27 56 1 0 0 0 0
28 30 1 0 0 0 0
28 57 1 0 0 0 0
29 31 2 0 0 0 0
29 58 1 0 0 0 0
30 32 2 0 0 0 0
30 59 1 0 0 0 0
31 32 1 0 0 0 0
31 60 1 0 0 0 0
32 61 1 0 0 0 0
M END
$$$$