D05XPU
-OEChem-10101305022D
79 80 0 1 0 0 0 0 0999 V2000
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8.9282 4.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 3.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 4.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 4.1550 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.3301 4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 4.6550 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
8.0622 4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 5.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 5.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 -0.3450 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
10.6603 6.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 6.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 6.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -4.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 7.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 7.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 7.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -4.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -4.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -5.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -5.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -6.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 7.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 3.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7196 4.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1181 4.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2573 4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5822 6.2376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1836 5.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 3.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 2.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8723 5.5724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2708 6.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6540 -2.7624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2554 -3.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5422 1.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9407 1.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 5.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 5.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0420 0.6919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4220 -0.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 7.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9272 7.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -4.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -4.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 8.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 4.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5263 5.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -6.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -6.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8363 7.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 7.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2163 8.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -7.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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41 78 1 0 0 0 0
M END
$$$$