79

C          0.81640        1.82210       -2.96380
C          0.02810        2.29820       -1.74190
C          0.64800        1.70740       -0.47340
C         -0.16350        2.15820        0.74520
N         -0.24770        3.62520        0.74070
C         -0.74510        4.30110       -0.46520
C          0.07350        3.82620       -1.66980
C          0.12400        4.33710        1.82300
O          0.04960        5.54750        1.80750
C          0.63220        3.62910        3.05250
C          0.98280        4.66060        4.12670
H          0.13410        5.32700        4.28080
C          2.18810        5.47140        3.67620
C          3.16800        5.78530        4.56190
S          4.30690        6.71360        3.57010
C          3.41750        6.61800        2.07950
N          2.36160        5.91500        2.43290
N          3.73830        7.14740        0.83490
C          4.87930        7.84640        0.67370
O          5.58130        8.09420        1.63500
N          5.24210        8.27070       -0.55300
C          6.53150        8.94550       -0.77050
C          7.24250        8.25330       -1.94440
O          6.35630        8.20220       -3.06500
C          5.17230        7.43310       -2.84030
C          4.35780        8.07830       -1.71330
C          3.24030        5.42480        6.00350
C          1.85530        4.93340        6.46810
H          1.17370        5.77840        6.56570
C          1.31100        3.93890        5.44040
C          0.01230        3.30850        5.95450
C          0.25240        2.61100        7.29170
C          0.73180        3.64970        8.31020
H         -0.01370        4.43910        8.40570
C          2.05050        4.24320        7.82160
C          2.55510        5.26470        8.84280
C          3.08500        3.12540        7.67540
O          3.38970        2.58690        8.96350
O          0.92960        3.02140        9.57840
C          2.35240        2.84860        5.18020
H          0.78340        0.73390       -3.01600
H          0.37500        2.24280       -3.86730
H          1.85220        2.15060       -2.87850
H         -1.00750        1.96920       -1.82710
H          0.63660        0.61920       -0.53580
H          1.67620        2.05540       -0.37490
H         -1.16660        1.73490        0.69320
H          0.33010        1.82280        1.65730
H         -0.63540        5.37960       -0.35120
H         -1.79560        4.05260       -0.61640
H          1.10690        4.15470       -1.55970
H         -0.34630        4.24610       -2.58390
H         -0.13940        2.95860        3.43070
H          1.52170        3.05260        2.79820
H          3.14100        7.01380        0.08240
H          6.36090        9.99540       -1.00860
H          7.14310        8.86710        0.12840
H          7.52430        7.24040       -1.65660
H          8.13590        8.81750       -2.21210
H          5.44660        6.41730       -2.55580
H          4.57590        7.40810       -3.75230
H          3.52910        7.42540       -1.43910
H          3.97140        9.04230       -2.04430
H          3.97490        4.63190        6.14480
H          3.53210        6.29990        6.58410
H         -0.73980        4.08680        6.08360
H         -0.34750        2.58040        5.22750
H         -0.67640        2.15930        7.64010
H          1.01320        1.84000        7.17030
H          1.82490        6.06750        8.94490
H          2.69490        4.77590        9.80700
H          3.50500        5.67830        8.50410
H          2.68170        2.33810        7.03860
H          3.99290        3.52720        7.22560
H          4.04050        1.87190        8.94700
H          0.13300        2.61230        9.94320
H          3.33230        3.19670        5.50690
H          2.08300        1.94930        5.73420
H          2.38370        2.62300        4.11430