56

C         -0.01730        1.42480        0.00990
O          0.00210       -0.00410        0.00200
C          0.60100       -0.60230       -1.04730
O          1.09330        0.07140       -1.93140
C          0.65870       -2.06960       -1.12240
C          1.26790       -2.68810       -2.17900
S          1.07390       -4.31840       -1.81000
C          0.19330       -4.13120       -0.27010
N          0.12150       -2.82100       -0.15620
N         -0.28670       -5.11190        0.58840
C         -0.93430       -4.76120        1.71710
O         -1.09800       -3.58930        1.98320
C         -1.45510       -5.82520        2.64860
C         -2.14390       -5.16390        3.84410
H         -1.45550       -4.46750        4.32280
C         -2.56170       -6.21860        4.83170
O         -2.17170       -6.13960        5.97740
N         -3.34630       -7.23500        4.48570
C         -3.82760       -7.48370        3.21250
C         -3.84050       -8.81280        2.78130
C         -4.30870       -9.14060        1.52880
C         -4.77480       -8.15040        0.67890
C         -4.76900       -6.83680        1.08400
C         -4.29220       -6.48490        2.35800
C         -4.30580       -5.06250        2.71910
O         -5.27070       -4.40250        2.38470
N         -3.33200       -4.44270        3.38770
C          1.94340       -2.06580       -3.37380
C          3.42480       -1.84260       -3.06330
C          4.10030       -1.22030       -4.25810
C          4.65850       -2.02530       -5.23350
C          5.27810       -1.45450       -6.32950
C          5.33920       -0.07880       -6.45030
C          4.78020        0.72610       -5.47530
C          4.15680        0.15530       -4.38150
H          1.00530        1.80210        0.00210
H         -0.54450        1.78590       -0.87320
H         -0.52750        1.77630        0.90670
H         -0.15580       -6.04910        0.37560
H         -2.17100       -6.45340        2.11860
H         -0.62510       -6.43780        3.00070
H         -3.60300       -7.85540        5.18580
H         -3.47900       -9.59100        3.43730
H         -4.31240      -10.17180        1.20790
H         -5.14270       -8.41080       -0.30250
H         -5.13360       -6.06910        0.41760
H         -3.41340       -3.49500        3.57790
H          1.84830       -2.73090       -4.23220
H          1.47170       -1.10980       -3.60090
H          3.51990       -1.17750       -2.20490
H          3.89660       -2.79860       -2.83620
H          4.61080       -3.10010       -5.13910
H          5.71480       -2.08340       -7.09120
H          5.82390        0.36710       -7.30620
H          4.82820        1.80090       -5.56950
H          3.71680        0.78420       -3.62160