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Figure 5
A view of the Hirshfeld surface mapped over the calculated electrostatic potential for (I)[link]. The potentials were calculated using the STO-3G basis set at Hartree–Fock level of theory over a range of −4.381 to 4.109 atomic units. The red and blue regions represent negative and positive electrostatic potentials, respectively.

Journal logoCRYSTALLOGRAPHIC
COMMUNICATIONS
ISSN: 2056-9890
Volume 76| Part 6| June 2020| Pages 835-840
https://doi.org/10.1107/S2056989020006271
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