42

C          1.66690       11.14470       -2.42280
N          1.67280        9.72670       -2.79070
C          1.16890        9.30780       -4.10100
C          2.15880        8.77410       -1.89220
C          2.74560        9.17770       -0.69950
C          3.22550        8.23320        0.18640
C          3.12250        6.88700       -0.11270
C          2.54410        6.48200       -1.30170
C          2.05700        7.42100       -2.18960
C          3.64740        5.85930        0.85640
H          3.53340        6.19690        1.88650
N          2.99940        4.54820        0.64860
N          3.79460        3.51210        0.27740
C          3.62720        2.15730       -0.00780
N          4.80300        1.66400       -0.30370
N          5.69750        2.58450       -0.22540
C          5.13860        3.70690        0.12310
S          5.39330        5.42840        0.48750
C          2.34990        1.41320        0.01400
C          1.13680        2.10340        0.03720
C         -0.05140        1.40310        0.05790
C         -0.04260        0.01930        0.05570
C          1.15620       -0.67080        0.03280
C          2.35180        0.01760        0.01190
N          1.15620       -2.15100        0.03010
O          0.10150       -2.76000        0.04810
O          2.21080       -2.76000        0.00990
H          2.60750       11.60320       -2.72800
H          0.83890       11.64660       -2.92340
H          1.54990       11.23950       -1.34320
H          1.16890        8.21940       -4.15920
H          0.15280        9.67880       -4.23500
H          1.81010        9.71360       -4.88350
H          2.82600       10.22890       -0.46520
H          3.68210        8.54630        1.11370
H          2.46950        5.43000       -1.53440
H          1.60130        7.10390       -3.11590
H          2.20650        4.63080        0.03010
H          1.12850        3.18340        0.03890
H         -0.99070        1.93590        0.07140
H         -0.97560       -0.52430        0.07170
H          3.28690       -0.52230       -0.00630