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1 DUMM DU M 0 -1 -2 0.000 0.000 0.000
2 DUMM DU M 1 0 -1 1.000 0.000 0.000
3 DUMM DU M 2 1 0 1.000 90.000 0.000
4 H11' H1 M 3 2 1 3.886 92.507 92.096
5 C1' CT M 4 3 2 1.090 102.037 71.294
6 H12' H1 E 5 4 3 1.090 109.478 183.234
7 H13' H1 E 5 4 3 1.090 107.820 59.290
8 N1 N* M 5 4 3 1.490 108.119 295.550
9 C6 CM M 8 5 4 1.360 121.134 81.573
10 H6 H4 E 9 8 5 1.080 119.949 0.042
11 C5 CM M 9 8 5 1.360 121.029 180.041
12 H5 HA E 11 9 8 1.090 119.994 180.067
13 C4 CA M 11 9 8 1.430 116.875 359.972
14 N4 N2 B 13 11 9 1.319 120.077 179.993
15 H41 H E 14 13 11 1.010 117.746 180.030
16 H42 H E 14 13 11 1.010 120.295 0.061
17 N3 NC M 13 11 9 1.330 121.703 0.075
18 C2 C M 17 13 11 1.360 120.533 359.923
19 O2 O E 18 17 13 1.239 122.457 180.051
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