BG6OH4
-OEChem-04042103513D
58 60 0 0 0 0 0 0 0999 V2000
-0.3063 2.8967 -0.9231 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.1642 -2.0005 1.3172 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.9840 -1.1640 -1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2293 2.1873 0.2753 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.0807 1.5845 0.8242 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.2324 1.2839 0.1807 N 0 0 0 0 0 0 0 0 0 0 0 0
4.8476 0.9083 -0.0463 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5398 0.2168 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6639 2.4291 -0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3625 0.7286 0.3866 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4496 2.8674 0.7297 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9985 0.4676 -0.9465 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0697 2.6547 1.0348 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5279 -0.8833 -0.5495 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1635 2.4050 0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5607 -0.9814 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9857 -2.0380 -1.1138 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0512 -2.2343 0.7511 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4761 -3.2908 -0.7454 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5087 -3.3890 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0221 0.5098 0.8515 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3224 0.0695 0.3162 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1418 -0.7671 1.0741 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7338 0.4891 -0.9489 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3727 -1.1840 0.5671 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7840 -0.7645 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9646 0.0719 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6697 -2.3831 2.5993 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3289 -0.6901 -2.5044 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0733 0.6390 0.9956 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6111 -0.8657 -0.2994 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3312 0.3850 -1.5107 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5401 2.7604 -1.1311 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5606 2.9270 0.2965 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4970 0.4258 1.4337 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4565 0.2318 0.0201 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3377 3.9522 0.6121 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6321 2.6716 1.7946 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8239 1.1898 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6989 0.4617 -2.0025 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1041 3.7417 1.1851 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0039 2.1956 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9901 -0.0896 0.8317 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1872 -1.9771 -1.8483 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8550 -2.3109 1.4775 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0552 -4.1898 -1.1862 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9295 1.1930 1.7487 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8908 -4.3644 0.4736 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7561 0.1411 1.8599 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7711 -1.0616 2.0502 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1154 1.1406 -1.5606 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2187 0.4370 -2.4451 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4259 -3.0305 3.0555 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5518 -1.5184 3.2613 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7523 -2.9760 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3125 -1.1052 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6320 -1.0568 -3.2657 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4310 0.4003 -2.5227 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 2 0 0 0 0
2 25 1 0 0 0 0
2 28 1 0 0 0 0
3 26 1 0 0 0 0
3 29 1 0 0 0 0
4 10 1 0 0 0 0
4 11 1 0 0 0 0
4 13 1 0 0 0 0
5 6 1 0 0 0 0
5 15 1 0 0 0 0
5 47 1 0 0 0 0
6 21 2 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 12 1 0 0 0 0
7 30 1 0 0 0 0
8 10 1 0 0 0 0
8 31 1 0 0 0 0
8 32 1 0 0 0 0
9 11 1 0 0 0 0
9 33 1 0 0 0 0
9 34 1 0 0 0 0
10 35 1 0 0 0 0
10 36 1 0 0 0 0
11 37 1 0 0 0 0
11 38 1 0 0 0 0
12 14 1 0 0 0 0
12 39 1 0 0 0 0
12 40 1 0 0 0 0
13 15 1 0 0 0 0
13 41 1 0 0 0 0
13 42 1 0 0 0 0
14 16 2 0 0 0 0
14 17 1 0 0 0 0
16 18 1 0 0 0 0
16 43 1 0 0 0 0
17 19 2 0 0 0 0
17 44 1 0 0 0 0
18 20 2 0 0 0 0
18 45 1 0 0 0 0
19 20 1 0 0 0 0
19 46 1 0 0 0 0
20 48 1 0 0 0 0
21 22 1 0 0 0 0
21 49 1 0 0 0 0
22 23 2 0 0 0 0
22 24 1 0 0 0 0
23 25 1 0 0 0 0
23 50 1 0 0 0 0
24 27 2 0 0 0 0
24 51 1 0 0 0 0
25 26 2 0 0 0 0
26 27 1 0 0 0 0
27 52 1 0 0 0 0
28 53 1 0 0 0 0
28 54 1 0 0 0 0
28 55 1 0 0 0 0
29 56 1 0 0 0 0
29 57 1 0 0 0 0
29 58 1 0 0 0 0
M END
$$$$