55

C         -0.01780        1.46480        0.01010
N          0.00210       -0.00410        0.00200
C          0.70620       -0.52750        1.18020
C          2.16280       -0.14880        1.10430
C          2.72340        0.50010        2.09470
C         -1.35970       -0.54860       -0.08250
C         -1.97100       -0.18540       -1.43720
H         -1.92600        0.89420       -1.58060
C         -1.19250       -0.88440       -2.55550
N         -2.09860       -1.76870       -3.30070
C         -3.17750       -1.00220       -3.93920
C         -4.01200       -0.30570       -2.86070
C         -3.43220       -0.64950       -1.48270
H         -4.00670       -0.15640       -0.69850
C         -3.46740       -2.17280       -1.30630
C         -2.64400       -2.82000       -2.43090
H         -3.28430       -3.48020       -3.01600
C         -1.49500       -3.62810       -1.82470
N         -0.64060       -4.14290       -2.89770
C          0.44150       -4.88860       -2.59840
S          0.81760       -5.23410       -0.96440
N          1.22740       -5.36220       -3.58550
C          2.40360       -6.17270       -3.26030
C          3.10510       -6.57330       -4.53250
C          4.08380       -5.88100       -5.14270
C          4.44840       -6.61570       -6.29420
C          3.67080       -7.71300       -6.31890
O          2.86310       -7.68490       -5.24620
H          1.00470        1.84210        0.00240
H         -0.54500        1.82590       -0.87300
H         -0.52800        1.81630        0.90690
H          0.26730       -0.10400        2.08370
H          0.61390       -1.61330        1.20600
H          2.74460       -0.41230        0.23340
H          3.76730        0.77150        2.04030
H          2.14160        0.76360        2.96560
H         -1.32440       -1.63310        0.02120
H         -1.96980       -0.12680        0.71630
H         -0.77660       -0.13700       -3.23110
H         -0.38410       -1.47360       -2.12240
H         -2.74730       -0.25450       -4.60550
H         -3.81350       -1.67720       -4.51180
H         -3.97590        0.77330       -3.01100
H         -5.04460       -0.65000       -2.91870
H         -3.03700       -2.43870       -0.34090
H         -4.49850       -2.52270       -1.35740
H         -0.90690       -2.98710       -1.16790
H         -1.90010       -4.46180       -1.25120
H         -0.85380       -3.94710       -3.82350
H          1.01430       -5.16640       -4.51140
H          3.08410       -5.59200       -2.63750
H          2.09090       -7.06670       -2.72080
H          4.50900       -4.94350       -4.81600
H          5.20580       -6.34730       -7.01590
H          3.69470       -8.48730       -7.07140