CELL  8.9871  8.9871  17.8935  90.0  90.0  90.0
AL     13     0.54280    0.54280    0.00000
F1      9     0.45715    0.42525    0.06986
F2      9     0.65992    0.62600    0.07107
F3      9     0.40503    0.68706    0.01728
C1      6     0.05888    0.39540    0.06629
C2      6     0.08398    0.49908    0.00330
H1      1     0.20180    0.51918    -0.00294
H2      1     0.02780    0.60288    0.01467
H3      1     0.04057    0.45131    -0.04761
N1      7     -0.07842    0.35549    0.08353
H4      1     -0.15400    0.42377    0.11556
H5      1     -0.14058    0.27115    0.05397
N2      7     0.17147    0.34340    0.10463
H6      1     0.24127    0.25259    0.08636
H7      1     0.22785    0.40521    0.14795
C3      6     0.90650    0.90650    0.00000
C4      6     1.02280    1.02280    0.00000
H8      1     1.02990    1.07235    -0.05487
H9      1     1.12864    0.97361    0.01438
H10     1     0.99484    1.10742    0.04049
N3      7     0.87839    0.83108    0.06149
H11     1     0.78525    0.85368    0.09791
H12     1     0.91906    0.71988    0.07180
RGNR  92