B48EZU
-OEChem-04022107032D
45 49 0 0 0 0 0 0 0999 V2000
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4.5106 -4.0715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6782 -0.7951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3984 2.5933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.7997 3.4024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.2748 -3.5513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0091 -1.5382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3181 -2.4893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 0.1560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0150 -1.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2962 -2.6972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7086 -2.4865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0383 0.8991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9654 -1.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6564 -1.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5124 -3.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7293 1.8502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3334 -0.7613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6028 -3.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6994 -2.7182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9875 -2.1549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3191 -0.9696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6200 -3.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3170 -3.1430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1905 3.5715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3930 2.4888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0566 4.0715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2959 -3.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9875 0.6446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8218 -0.1351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4200 0.4106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5858 1.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3476 2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1819 1.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5313 -0.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1826 -4.1486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3970 -1.6894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5152 -3.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9056 -0.5077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8093 -4.5075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3942 -2.0865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6241 3.8237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7030 1.9519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1214 4.6881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 2 0 0 0 0
2 16 2 0 0 0 0
3 7 1 0 0 0 0
3 9 1 0 0 0 0
3 15 1 0 0 0 0
4 17 1 0 0 0 0
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5 27 2 0 0 0 0
5 28 1 0 0 0 0
6 29 3 0 0 0 0
7 8 2 0 0 0 0
7 10 1 0 0 0 0
8 11 1 0 0 0 0
8 16 1 0 0 0 0
9 13 1 0 0 0 0
9 30 1 0 0 0 0
9 31 1 0 0 0 0
10 12 1 0 0 0 0
10 18 2 0 0 0 0
11 14 2 0 0 0 0
11 19 1 0 0 0 0
12 16 1 0 0 0 0
12 20 2 0 0 0 0
13 17 1 0 0 0 0
13 32 1 0 0 0 0
13 33 1 0 0 0 0
14 15 1 0 0 0 0
14 21 1 0 0 0 0
17 34 1 0 0 0 0
17 35 1 0 0 0 0
18 22 1 0 0 0 0
18 36 1 0 0 0 0
19 23 2 0 0 0 0
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20 25 1 0 0 0 0
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22 25 2 0 0 0 0
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23 24 1 0 0 0 0
23 41 1 0 0 0 0
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26 28 2 0 0 0 0
26 43 1 0 0 0 0
27 44 1 0 0 0 0
28 45 1 0 0 0 0
M END
$$$$