20
6XI
C          3.46500        0.51200       -0.47900
C          3.27100       -0.45400        0.52900
C         -0.54600        2.02700        0.15300
C          2.26200        1.05500       -0.75600
C          1.95700       -0.46700        0.83100
C         -1.88000        2.10900        0.15100
C         -0.03800        0.74700        0.05800
C         -1.01700       -0.21500       -0.02200
C         -0.79300       -1.60900       -0.12700
N          1.33000        0.45800        0.04500
O          0.34400       -2.04300       -0.15300
O         -1.84000       -2.45800       -0.19900
S         -2.59200        0.56500        0.02000
H          4.40400        0.76700       -0.94700
H          4.03500       -1.07200        0.97700
H          0.08800        2.89800        0.22400
H          2.06900        1.82800       -1.48500
H          1.48200       -1.09900        1.56700
H         -2.43400        3.03300        0.21800
H         -1.58800       -3.38900       -0.26800
