B1V6PB
-OEChem-04022106492D
63 67 0 0 0 0 0 0 0999 V2000
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2.1888 -1.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8442 -0.1339 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.5644 3.2545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.1750 -0.8770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5352 0.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2043 1.5603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8953 2.5114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4840 -1.8281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1810 -0.8796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4622 -2.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2554 4.2056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5425 3.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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4.8746 -1.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6783 -2.4103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9245 4.9487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2117 3.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4994 -0.1001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7688 -3.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
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9.4829 -2.4818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1660 -1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1300 1.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4193 -4.9487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1281 -1.9402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1534 1.3057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9877 0.5261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5860 1.0717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7517 1.8514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5136 2.9999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3478 2.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8737 4.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7080 3.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3103 2.4718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0683 2.7180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1568 5.5236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3987 5.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5934 3.3012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7591 4.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6973 0.4875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3486 -3.4874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5629 -1.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6812 -2.6490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7191 1.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3234 1.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5410 1.5802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9602 -4.5321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0027 -5.4079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8785 -5.3654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5905 -2.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5412 -1.4779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6658 -1.5272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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M END
$$$$