81

C         12.26450        1.63330       -4.96210
C         11.84140        1.81990       -3.50370
C         11.95440        0.48430       -2.76510
C         11.56300        0.68230       -1.29730
N         10.22690        1.29120       -1.24220
C          9.98260        2.52800       -1.99670
C         10.39330        2.31230       -3.45220
C          9.24270        0.72280       -0.51780
O          9.45560       -0.30090        0.09660
C          7.87760        1.35950       -0.47130
C          6.88870        0.39800        0.19100
H          7.33780       -0.02210        1.09100
C          6.54560       -0.73130       -0.78260
H          5.84110       -1.41630       -0.31080
C          5.91520       -0.14150       -2.04580
C          4.63920        0.61590       -1.67320
C          4.98230        1.74520       -0.69950
H          5.68680        2.43020       -1.17140
C          5.61270        1.15540        0.56370
C          4.62390        0.19390        1.22600
C          3.34780        0.95140        1.59860
C          2.71750        1.54110        0.33540
H          2.47300        0.73660       -0.35820
C          3.70630        2.50260       -0.32690
C          3.07590        3.09230       -1.59010
C          4.04950        3.63190        0.64680
O          2.89980        4.45770        0.84270
O          1.50650        2.26000        0.68910
C          0.35700        1.55860        0.68850
O          0.36570        0.37820        0.40030
N         -0.80390        2.16730        1.00210
C         -2.01080        1.46580        0.90270
C         -3.16770        2.12530        0.50560
C         -4.35900        1.43320        0.40280
C         -4.40670        0.08560        0.70350
C         -3.25430       -0.57900        1.10640
C         -2.05450        0.11320        1.20590
S         -3.31580       -2.29750        1.49100
C         -5.05220       -2.74620        1.21890
C          5.95590        2.28470        1.53730
O          7.73740       -1.43870       -1.13070
H         11.61460        0.89880       -5.43780
H         12.18400        2.58450       -5.48830
H         13.29620        1.28370       -4.99920
H         12.49170        2.55410       -3.02800
H         12.98110        0.12280       -2.82220
H         11.28620       -0.24380       -3.22480
H         12.28450        1.33980       -0.81220
H         11.54670       -0.28130       -0.78810
H          8.92320        2.78060       -1.95100
H         10.57250        3.33900       -1.56980
H         10.30880        3.25180       -3.99830
H          9.73940        1.56760       -3.90610
H          7.54520        1.58090       -1.48540
H          7.92700        2.28350        0.10480
H          5.67070       -0.94600       -2.73950
H          6.61970        0.54350       -2.51770
H          3.93470       -0.06910       -1.20130
H          4.19010        1.03600       -2.57310
H          5.07300       -0.22620        2.12590
H          4.37940       -0.61060        0.53230
H          3.59230        1.75590        2.29230
H          2.64340        0.26640        2.07050
H          2.16680        3.63200       -1.32460
H          3.78040        3.77730       -2.06190
H          2.83140        2.28780       -2.28370
H          4.35850        3.20690        1.60170
H          4.86180        4.23150        0.23600
H          3.04480        5.19600        1.45010
H         -0.80280        3.09140        1.29680
H         -3.13480        3.17960        0.27370
H         -5.25570        1.94750        0.09030
H         -5.34030       -0.45180        0.62580
H         -1.15760       -0.40050        1.51900
H         -5.68780       -2.15490        1.87800
H         -5.32050       -2.54770        0.18120
H         -5.19170       -3.80560        1.43400
H          6.93150        2.09470        1.98480
H          5.98100        3.23270        0.99990
H          5.19960        2.33120        2.32090
H          7.59480       -2.17040       -1.74670