BH02CK
-OEChem-04042105393D
49 52 0 1 0 0 0 0 0999 V2000
-3.8544 1.0408 -1.3375 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2200 2.5005 0.7100 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1393 4.5107 0.8177 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9015 2.0520 -1.6559 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1948 -3.6940 1.2724 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2012 3.0955 2.0696 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5842 1.0161 0.7635 O 0 5 0 0 0 0 0 0 0 0 0 0
5.5578 2.5994 -0.3585 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3153 0.1248 -1.1217 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5630 1.4736 0.1956 N 0 3 0 0 0 0 0 0 0 0 0 0
-0.3089 -1.1197 -0.5077 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5318 0.5987 -1.7661 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5582 1.0878 -0.7402 C 0 0 1 0 0 0 0 0 0 0 0 0
0.7891 -1.6060 0.1023 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2723 2.5219 -0.2534 C 0 0 1 0 0 0 0 0 0 0 0 0
-1.3989 -2.0991 -0.3935 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0333 -0.8550 0.1518 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8395 0.9405 -1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0598 0.4077 -0.4594 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9182 -3.2012 0.3133 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4714 -2.9414 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5033 3.2014 0.3757 C 0 0 1 0 0 0 0 0 0 0 0 0
-2.7178 -2.1334 -0.8237 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1943 -1.3294 0.7743 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2299 1.1793 -0.4447 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6682 -4.3258 0.6147 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0501 2.4216 1.5704 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3769 0.6932 0.1794 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3591 -0.5586 0.7874 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5088 -3.2569 -0.5364 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9878 -4.3450 0.1776 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9102 -0.1705 -2.4462 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2852 1.4263 -2.4437 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5834 0.4276 0.1317 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9436 3.1590 -1.0843 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2915 3.3388 -0.3733 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1905 -1.3576 -1.4025 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2221 -2.3000 1.2598 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2318 2.1557 -0.9231 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2520 -5.1602 1.1671 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3507 1.4060 1.3015 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3184 2.3808 2.3838 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8388 1.6144 -2.1229 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2345 -0.9705 1.2836 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3788 2.5476 0.2286 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5402 -3.2871 -0.8787 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6179 -5.2046 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9287 4.9128 1.2189 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5227 2.5842 2.8317 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 43 1 0 0 0 0
2 15 1 0 0 0 0
2 45 1 0 0 0 0
3 22 1 0 0 0 0
3 48 1 0 0 0 0
4 18 2 0 0 0 0
5 21 2 0 0 0 0
6 27 1 0 0 0 0
6 49 1 0 0 0 0
7 10 1 0 0 0 0
8 10 2 0 0 0 0
9 11 1 0 0 0 0
9 12 1 0 0 0 0
9 18 1 0 0 0 0
10 28 1 0 0 0 0
11 14 2 0 0 0 0
11 16 1 0 0 0 0
12 13 1 0 0 0 0
12 32 1 0 0 0 0
12 33 1 0 0 0 0
13 15 1 0 0 0 0
13 34 1 0 0 0 0
14 17 1 0 0 0 0
14 21 1 0 0 0 0
15 22 1 0 0 0 0
15 35 1 0 0 0 0
16 20 1 0 0 0 0
16 23 2 0 0 0 0
17 19 2 0 0 0 0
17 24 1 0 0 0 0
18 19 1 0 0 0 0
19 25 1 0 0 0 0
20 21 1 0 0 0 0
20 26 2 0 0 0 0
22 27 1 0 0 0 0
22 36 1 0 0 0 0
23 30 1 0 0 0 0
23 37 1 0 0 0 0
24 29 2 0 0 0 0
24 38 1 0 0 0 0
25 28 2 0 0 0 0
25 39 1 0 0 0 0
26 31 1 0 0 0 0
26 40 1 0 0 0 0
27 41 1 0 0 0 0
27 42 1 0 0 0 0
28 29 1 0 0 0 0
29 44 1 0 0 0 0
30 31 2 0 0 0 0
30 46 1 0 0 0 0
31 47 1 0 0 0 0
M CHG 2 7 -1 10 1
M END
$$$$