B6BWH4
-OEChem-04022118543D
49 50 0 1 0 0 0 0 0999 V2000
6.1061 3.7948 0.5940 F 0 0 0 0 0 0 0 0 0 0 0 0
-1.3967 1.1200 1.8243 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2228 -0.9703 1.8798 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7135 1.3018 -1.5209 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.7763 0.6796 1.8703 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6956 -5.8769 -1.4257 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8580 2.1694 -2.9945 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1740 2.7983 -1.6076 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8510 0.2365 0.5346 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.6580 0.1337 0.1420 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3539 -0.5433 0.4026 C 0 0 1 0 0 0 0 0 0 0 0 0
-0.2886 -1.8493 1.2026 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5078 0.3228 0.8954 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5067 -2.9237 0.5019 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8830 0.8669 0.3666 C 0 0 1 0 0 0 0 0 0 0 0 0
-4.6854 1.0088 -0.9298 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8790 -3.0337 0.7268 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1299 -3.8064 -0.3707 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2895 1.1067 -0.4539 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7327 0.2045 1.4383 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5642 1.8174 -0.1765 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6145 -4.0263 0.0794 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6055 -4.7989 -1.0183 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9778 -4.9090 -0.7931 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1373 2.0833 -1.8454 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3696 2.2425 -1.2331 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9555 2.0602 1.1401 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5662 2.9101 -0.9731 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1522 2.7279 1.4003 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9575 3.1528 0.3437 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5040 -0.7569 -0.6636 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3027 -2.2328 1.3802 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1281 -1.6747 2.2039 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6110 1.8510 0.7684 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3892 0.1095 1.3846 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6709 -0.6065 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7011 0.0602 -1.4796 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7212 1.2897 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3868 -2.3524 1.4043 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1980 -3.7288 -0.5561 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6830 -4.1013 0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1042 -5.4829 -1.6975 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0843 2.0590 -2.2657 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3439 1.7776 1.9916 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1941 3.2405 -1.7952 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4540 2.9240 2.4249 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7862 -1.3781 2.5716 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6269 -5.8068 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5097 2.8644 -3.5929 H 0 0 0 0 0 0 0 0 0 0 0 0
1 30 1 0 0 0 0
2 13 2 0 0 0 0
3 20 1 0 0 0 0
3 47 1 0 0 0 0
4 19 2 0 0 0 0
5 20 2 0 0 0 0
6 24 1 0 0 0 0
6 48 1 0 0 0 0
7 25 1 0 0 0 0
7 49 1 0 0 0 0
8 25 2 0 0 0 0
9 11 1 0 0 0 0
9 19 1 0 0 0 0
9 35 1 0 0 0 0
10 13 1 0 0 0 0
10 15 1 0 0 0 0
10 36 1 0 0 0 0
11 12 1 0 0 0 0
11 13 1 0 0 0 0
11 31 1 0 0 0 0
12 14 1 0 0 0 0
12 32 1 0 0 0 0
12 33 1 0 0 0 0
14 17 2 0 0 0 0
14 18 1 0 0 0 0
15 16 1 0 0 0 0
15 20 1 0 0 0 0
15 34 1 0 0 0 0
16 25 1 0 0 0 0
16 37 1 0 0 0 0
16 38 1 0 0 0 0
17 22 1 0 0 0 0
17 39 1 0 0 0 0
18 23 2 0 0 0 0
18 40 1 0 0 0 0
19 21 1 0 0 0 0
21 26 2 0 0 0 0
21 27 1 0 0 0 0
22 24 2 0 0 0 0
22 41 1 0 0 0 0
23 24 1 0 0 0 0
23 42 1 0 0 0 0
26 28 1 0 0 0 0
26 43 1 0 0 0 0
27 29 2 0 0 0 0
27 44 1 0 0 0 0
28 30 2 0 0 0 0
28 45 1 0 0 0 0
29 30 1 0 0 0 0
29 46 1 0 0 0 0
M END
$$$$