B1DH4G
-OEChem-04022109513D
48 50 0 1 0 0 0 0 0999 V2000
2.7456 1.0403 1.1017 S 0 0 0 0 0 0 0 0 0 0 0 0
-5.8932 -2.9072 0.6743 F 0 0 0 0 0 0 0 0 0 0 0 0
5.6796 -1.2210 -0.3859 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9805 2.4710 1.0598 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1841 0.2542 2.2391 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1067 3.3493 -1.0118 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9508 -1.3670 -1.3869 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5359 1.8741 -0.7098 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3257 0.3289 -0.3320 N 0 0 1 0 0 0 0 0 0 0 0 0
-3.0912 0.3222 0.3643 N 0 0 0 0 0 0 0 0 0 0 0 0
3.2918 -1.1646 -0.4366 C 0 0 1 0 0 0 0 0 0 0 0 0
3.2379 -1.4248 -1.9408 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8479 0.9006 -1.6276 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3574 -0.2935 -2.4336 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5197 -1.7760 0.2131 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0088 0.7788 0.9068 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2335 1.7437 0.2621 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1144 1.4803 0.1418 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7088 0.3180 0.6288 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4245 -0.4026 1.4052 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9477 -0.6429 1.2688 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9977 -0.7360 0.7383 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1776 2.2733 -0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4659 1.4764 -0.3022 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0812 -1.8060 -0.3452 C 0 0 1 0 0 0 0 0 0 0 0 0
6.8695 -1.7552 0.1811 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6357 -3.1143 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3869 -1.5729 0.0186 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8214 -2.4091 -2.1752 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2244 -1.3538 -2.4134 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7189 1.3518 -2.1181 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0923 1.6782 -1.5473 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4391 -0.1310 -3.5119 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3073 -0.5032 -2.1972 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5143 -2.8620 0.0595 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5392 -1.5868 1.2902 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6492 2.6694 -0.1174 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0281 -1.1511 1.9123 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3780 -1.5592 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9872 -0.2876 0.8913 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6728 -1.1540 1.6971 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0976 -2.0013 -0.7875 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7254 -1.2958 -0.3204 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9144 -2.8378 0.0284 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9235 -1.5215 1.2488 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7156 -3.8633 -0.5965 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0210 -3.5149 1.0081 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5669 -0.5584 -1.7661 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 9 1 0 0 0 0
1 16 1 0 0 0 0
2 27 1 0 0 0 0
3 15 1 0 0 0 0
3 26 1 0 0 0 0
6 23 2 0 0 0 0
7 25 1 0 0 0 0
7 48 1 0 0 0 0
8 24 2 0 0 0 0
9 11 1 0 0 0 0
9 13 1 0 0 0 0
10 19 1 0 0 0 0
10 22 1 0 0 0 0
10 24 1 0 0 0 0
11 12 1 0 0 0 0
11 15 1 0 0 0 0
11 28 1 0 0 0 0
12 14 1 0 0 0 0
12 29 1 0 0 0 0
12 30 1 0 0 0 0
13 14 1 0 0 0 0
13 31 1 0 0 0 0
13 32 1 0 0 0 0
14 33 1 0 0 0 0
14 34 1 0 0 0 0
15 35 1 0 0 0 0
15 36 1 0 0 0 0
16 17 2 0 0 0 0
16 20 1 0 0 0 0
17 18 1 0 0 0 0
17 37 1 0 0 0 0
18 19 2 0 0 0 0
18 23 1 0 0 0 0
19 21 1 0 0 0 0
20 21 2 0 0 0 0
20 38 1 0 0 0 0
21 39 1 0 0 0 0
22 25 1 0 0 0 0
22 40 1 0 0 0 0
22 41 1 0 0 0 0
23 24 1 0 0 0 0
25 27 1 0 0 0 0
25 42 1 0 0 0 0
26 43 1 0 0 0 0
26 44 1 0 0 0 0
26 45 1 0 0 0 0
27 46 1 0 0 0 0
27 47 1 0 0 0 0
M END
$$$$