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. 2008 Jan 9;64(Pt 2):o404. doi: 10.1107/S1600536807068274
x y z Uiso*/Ueq
C1 0.9665 (3) 0.7781 (5) 0.84935 (11) 0.0179 (5)
N1 0.7888 (3) 0.8052 (4) 0.79739 (10) 0.0185 (4)
H1 0.7443 0.9655 0.7857 0.022*
N2 0.0763 (3) −0.1088 (4) 0.56535 (9) 0.0180 (4)
O1 0.7161 (3) 0.3675 (4) 0.77761 (9) 0.0227 (4)
O2 0.5362 (3) 0.6890 (3) 0.71426 (8) 0.0196 (4)
O3 −0.1087 (2) −0.1712 (4) 0.58598 (9) 0.0248 (4)
O4 0.1657 (3) −0.2175 (4) 0.51627 (8) 0.0231 (4)
C2 1.1431 (4) 0.9546 (5) 0.84631 (12) 0.0219 (5)
H2 1.1414 1.0883 0.8110 0.026*
C3 1.3226 (4) 0.9341 (6) 0.89534 (12) 0.0248 (5)
H3 1.4432 1.0546 0.8935 0.030*
C4 1.3255 (4) 0.7399 (6) 0.94631 (12) 0.0257 (6)
H4 1.4489 0.7249 0.9792 0.031*
C5 1.1480 (4) 0.5660 (6) 0.94961 (12) 0.0261 (5)
H5 1.1498 0.4330 0.9851 0.031*
C6 0.9670 (4) 0.5853 (6) 0.90111 (11) 0.0214 (5)
H6 0.8451 0.4669 0.9037 0.026*
C7 0.6852 (4) 0.5994 (5) 0.76518 (11) 0.0169 (4)
C8 0.4214 (4) 0.4908 (5) 0.67556 (11) 0.0177 (5)
C9 0.5166 (3) 0.3802 (5) 0.61711 (11) 0.0190 (5)
H9 0.6578 0.4381 0.6027 0.023*
C10 0.4012 (4) 0.1825 (5) 0.58006 (11) 0.0187 (5)
H10 0.4625 0.1017 0.5400 0.022*
C11 0.1954 (3) 0.1055 (5) 0.60271 (11) 0.0161 (4)
C12 0.0975 (4) 0.2213 (5) 0.65993 (11) 0.0189 (5)
H12 −0.0457 0.1672 0.6735 0.023*
C13 0.2135 (4) 0.4187 (5) 0.69708 (11) 0.0198 (5)
H13 0.1508 0.5024 0.7365 0.024*