D0T8BO
-OEChem-09301911172D
49 53 0 0 0 0 0 0 0999 V2000
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4.9511 3.9618 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
10.5063 -5.1425 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
3.5851 0.9320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
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2.6678 2.8094 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.3107 4.5042 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.5998 5.6610 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.1831 -0.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3171 -0.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1831 -1.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4511 -0.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0771 -2.1027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3171 -2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4511 -1.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0771 -0.0333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5851 -0.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4511 2.4320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4511 1.4320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9831 -0.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6464 3.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9570 3.9661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9257 -3.6126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2558 3.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2892 4.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9141 -4.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7974 -3.1226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7743 -5.1225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6576 -3.6326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.5537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6461 -4.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3171 -2.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9142 -1.8780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8540 1.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0699 0.5866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8951 0.4689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0481 0.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2751 -0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5250 -3.4064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5189 -0.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8451 2.8230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3736 -4.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8046 -2.5027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1981 -3.3288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3933 3.4258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1858 6.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2065 5.7888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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32 47 1 0 0 0 0
M END
$$$$