TITL 
CELL 0.71073 6.9196 14.5749 9.7248 90 90.637 90
ZERR 4 0.0001 0.0002 0.0001 0 0.001 0
LATT 1
SYMM 0.5-X,0.5+Y,0.5-Z

SFAC C H F N
UNIT 40 40 8 16


L.S. 4
PLAN  20
more -3
fmap 2
REM <HKL>C:/Users/Horst/AppData/Roaming/Olex2u/samples/THPP/thpp.hkl</HKL>
WGHT 0.1
FVAR 0.35838 0.87977

F1    3     0.16726  0.42638 -0.23772  11.00000  0.03596  0.02944  0.01904 =
 -0.00761 -0.00298 -0.00009 
F2    3     0.13095  0.31497 -0.01246  11.00000  0.04052  0.01691  0.03281 =
 -0.00250 -0.00502 -0.00279 
N8    4     0.36220  0.66937  0.07644  11.00000  0.02801  0.01729  0.01820 =
 -0.00038  0.00220 -0.00146 
N3    4     0.22193  0.43032  0.12983  11.00000  0.02353  0.01895  0.02140 =
 0.00021 -0.00147 -0.00004 
C9    1     0.30101  0.58265  0.04215  11.00000  0.01747  0.01804  0.01766 =
 -0.00073  0.00094  0.00221 
C4    1     0.27507  0.51672  0.15265  11.00000  0.02018  0.01935  0.01696 =
 0.00027  0.00016  0.00159 
N5    4     0.30293  0.54252  0.28533  11.00000  0.03661  0.02191  0.01588 =
 0.00077 -0.00090 -0.00391 
C2    1     0.18838  0.40270  0.00228  11.00000  0.02311  0.01671  0.02386 =
 -0.00235 -0.00203  0.00103 
C10   1     0.26210  0.54987 -0.09061  11.00000  0.01942  0.02080  0.01702 =
 -0.00001  0.00153  0.00268 
C1    1     0.20604  0.45735 -0.10937  11.00000  0.02242  0.02167  0.01778 =
 -0.00389 -0.00127  0.00281 
C11   1     0.26071  0.60304 -0.21444  11.00000  0.03058  0.02565  0.01889 =
 -0.00137  0.00044  0.00016 
C13   1     0.26803  0.47611  0.39401  11.00000  0.03989  0.02833  0.01867 =
 0.00388 -0.00072 -0.00350 
AFIX 137
H13a  2     0.13843  0.45310  0.38566  11.00000 -1.50000 
H13b  2     0.28482  0.50521  0.48189  11.00000 -1.50000 
H13c  2     0.35780  0.42622  0.38616  11.00000 -1.50000 
AFIX 0
C6    1     0.36454  0.63430  0.32066  11.00000  0.04896  0.02569  0.02000 =
 -0.00456 -0.00017 -0.00449 
PART 1
AFIX 23
H6aa  2     0.50402  0.63531  0.33167  21.00000 -1.20000 
H6ab  2     0.30820  0.65183  0.40769  21.00000 -1.20000 
AFIX 0
PART 0
PART 2
AFIX 43
H6b   2     0.37703  0.65182  0.41228 -21.00000 -1.20000 
AFIX 0
PART 0
N12   4     0.25129  0.63888 -0.31966  11.00000  0.05489  0.03497  0.02311 =
 0.00384 -0.00181 -0.00450 
PART 1
C7a   1     0.30537  0.70214  0.21212  21.00000  0.03415  0.02081  0.02014 =
 -0.00399  0.00271  0.00061 
AFIX 23
H7aa  2     0.16643  0.71078  0.21393  21.00000 -1.20000 
H7ab  2     0.36635  0.76084  0.23069  21.00000 -1.20000 
AFIX 0
PART 0
C14   1     0.39584  0.73936 -0.02671  11.00000  0.03778  0.02073  0.02508 =
 0.00407  0.00124 -0.00460 
AFIX 137
H14a  2     0.46890  0.71364 -0.10068  11.00000 -1.50000 
H14b  2     0.46673  0.78927  0.01392  11.00000 -1.50000 
H14c  2     0.27415  0.76146 -0.06159  11.00000 -1.50000 
AFIX 0
PART 2
C7b   1     0.40368  0.69420  0.21920 -21.00000  0.02814  0.02120  0.02427 =
 -0.00252 -0.00560  0.00546 
AFIX 43
H7b   2     0.45695  0.75118  0.24002 -21.00000 -1.20000 
AFIX 0
HKLF 4
END

