|
CHARGE=0 rep739sys037g02pt100ab H=2.306+rep739sys037g02pt100a+rep739sys037g02pt100b HR=NCIA HWT=10 H 0.34197624 +0 -0.55665534 +0 0.46172187 +0 H 0.65897624 +1 -1.07265534 +0 0.88972187 +0 C -1.51778043 +0 1.86760248 +1 0.47574904 +0 Br -0.71547415 +0 1.16462038 +0 -0.96600295 +0 N -2.03270463 +0 2.31949440 +0 1.40193410 +0