45

C          2.50130        1.44760       -0.01360
C          1.06130        1.89190        0.00210
C         -0.01260        1.07580        0.00800
C         -1.15550        1.89630        0.01710
C         -0.71200        3.18700        0.02520
O          0.63590        3.16540        0.01250
C         -1.55410        4.38700        0.03840
N         -1.00550        5.56650        0.03900
N         -1.81030        6.71330        0.05160
C         -3.25290        6.53720        0.05790
C         -3.97720        7.84140        0.14480
O         -5.18910        7.81400        0.18160
N         -3.38030        9.03450        0.17950
C         -4.20930       10.24660        0.35260
C         -3.71700       11.27630       -0.63900
C         -2.56670       11.15060       -1.33540
C         -2.44530       12.32950       -2.16900
C         -1.47630       12.74490       -3.08740
C         -1.68910       13.94930       -3.71150
C         -2.80690       14.72530       -3.45200
C         -3.78160       14.33810       -2.54880
C         -3.59200       13.11990       -1.89950
N         -4.33700       12.45150       -0.97100
H         -5.17880       12.76200       -0.60250
C         -1.62270        9.98030       -1.22930
C         -1.93330        9.20880        0.06120
H         -1.58980        9.79550        0.91310
C         -1.20900        7.90140        0.05180
O          0.00400        7.92410        0.04430
H          2.83890        1.34560       -1.04500
H          3.11560        2.18830        0.49830
H          2.59080        0.48740        0.49460
H          0.00210       -0.00410        0.00200
H         -2.18450        1.56830        0.01930
H         -2.62980        4.29170        0.04760
H         -3.55100        6.02320       -0.85600
H         -3.53110        5.92310        0.91440
H         -4.10030       10.62820        1.36780
H         -5.25500       10.01160        0.15440
H         -0.60150       12.14690       -3.29580
H         -0.96180       14.30300       -4.42720
H         -2.92230       15.66430       -3.97300
H         -4.64870       14.95230       -2.35550
H         -0.59480       10.34160       -1.20030
H         -1.75470        9.32290       -2.08860