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Figure 7
(a) Difference between experimentally refined and the density calculated from the invariom database parameters using the same geometry indicating crystal-field effects in a qualitative way. (b) Difference between the density from `whole molecule' and invariom database parameters. Contour lines are 0.025 e Å−3 with blue indicating positive and red negative features.

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ISSN: 2053-2733
Volume 63| Part 5| August 2007| Pages 426-436
doi:10.1107/S0108767307039116
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