BNTL71
-OEChem-04012117222D
50 52 0 1 0 0 0 0 0999 V2000
2.5369 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.6651 2.5242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.6651 0.4758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.2690 2.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.1350 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.1350 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8950 0.4653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8950 2.5347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8010 0.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8010 2.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6613 3.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6720 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5335 2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7365 2.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0044 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8015 0.0251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7924 2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1909 1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8878 -0.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8878 3.1546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2033 0.7838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2813 3.5265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6589 4.1441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0413 3.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6720 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7830 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0230 -3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 40 1 0 0 0 0
2 14 1 0 0 0 0
2 41 1 0 0 0 0
3 21 1 0 0 0 0
3 25 1 0 0 0 0
4 20 1 0 0 0 0
4 43 1 0 0 0 0
5 22 1 0 0 0 0
5 26 1 0 0 0 0
6 24 1 0 0 0 0
6 47 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 13 1 1 0 0 0
7 27 1 0 0 0 0
8 10 1 0 0 0 0
8 14 1 6 0 0 0
8 28 1 0 0 0 0
9 11 1 0 0 0 0
9 15 1 6 0 0 0
9 29 1 0 0 0 0
10 12 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 12 1 0 0 0 0
11 16 2 0 0 0 0
12 17 2 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
15 18 2 0 0 0 0
15 19 1 0 0 0 0
16 20 1 0 0 0 0
16 36 1 0 0 0 0
17 21 1 0 0 0 0
17 37 1 0 0 0 0
18 22 1 0 0 0 0
18 38 1 0 0 0 0
19 23 2 0 0 0 0
19 39 1 0 0 0 0
20 21 2 0 0 0 0
22 24 2 0 0 0 0
23 24 1 0 0 0 0
23 42 1 0 0 0 0
25 44 1 0 0 0 0
25 45 1 0 0 0 0
25 46 1 0 0 0 0
26 48 1 0 0 0 0
26 49 1 0 0 0 0
26 50 1 0 0 0 0
M END
$$$$