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CHARGE=0 rep739sys048g02pt100ab H=2.067+rep739sys048g02pt100a+rep739sys048g02pt100b HR=NCIA HWT=10 C -2.73533144 +0 -0.05993277 +0 0.22294989 +0 H -3.79733144 +1 -0.08393277 +0 0.30894989 +0 N -1.59433144 +0 -0.03493277 +1 0.12994989 +0 C 1.54182662 +0 1.61752071 +0 1.08927468 +0 I 1.47795521 +0 0.03238289 +0 -0.12046436 +0 N 1.57881605 +0 2.53346970 +0 1.78931412 +0