cg3, N=67, gradient in meV/Ao, 2023-04-17
                       optimization      SP     finerSP
                      nopt  |G| maxG  |G| maxG  |G| maxG
anthracene             86    1    1    1    1    1    1
anthraquinone           1    1    1    1    1    1    1
benzene                10    1    1    1    1    1    1
benzeneF6              71    1    1    1    1    1    1
benzeneO2               1    1    1    1    1    1    1
benzodithiopheneO2      7    1    1    1    1    1    1
benzotrithiophene      71    1    1    1    2    1    1
benzotrithiopheneA      6    0    1    0    1    0    1
bithiophene             5    1    1    1    1    1    1
BODIPY                  3    0    1    0    1    1    1
BTBT                    3    1    1    2    3    2    3
C60                    67    0    1    1    1    1    1
carbazole               4    1    1    1    1    1    1
carbazoleNO2b          80    1    1    1    1    1    1
chrysene               40    1    1    1    1    1    1
coronene                1    1    1    1    1    1    1
DATT                    6    0    1    1    1    1    1
DBTTF                  86    1    1    1    1    1    1
dibenzoindigo           4    0    1    1    1    1    1
DNBDT                  25    0    1    1    2    0    1
DNTT                    7    0    1    1    1    1    1
hexacene               69    0    1    1    1    1    2
HMTTF                  69    1    1    1    1    1    1
ICZb                    8    1    1    1    1    1    1
ICZbCl2c               33    1    1    1    1    1    1
IF12b                   1    1    1    0    1    0    1
IF21a                  12    1    1    1    1    1    1
indigo                  1    1    1    1    1    1    1
indigoCl2              31    1    1    1    1    1    1
naphthalene             1    1    1    1    1    1    1
NDFPh                   4    1    1    1    1    1    1
NDI                     1    1    1    1    1    1    1
NDT                    26    0    1    1    1    1    1
oligothiophene4         7    1    1    1    1    0    1
oligothiophene6         4    0    1    1    1    0    1
OPV3CN                  9    1    1    1    1    1    1
PBBTZ                   5    1    1    1    1    1    1
PDI                    16    1    1    1    1    1    1
pentacene              49    1    1    1    1    1    1
pentaceneN2Cl4         34    1    1    1    1    1    1
pentaceneN4O2          33    1    1    1    1    1    1
perylene               56    1    1    1    1    1    1
phenazine               6    1    1    1    1    1    1
PTCDA                  57    0    1    1    1    1    1
pyrene                  1    1    1    1    1    1    1
quinacridone            4    1    1    1    1    1    1
spirobidibenzosilole    6    0    1    1    1    0    1
spirobifluorene        49    0    1    1    1    1    1
stilbene                4    1    1    1    1    1    1
TCNQ                   76    1    1    1    1    1    1
TCNQ-F2                 7    0    1    1    1    1    1
TCNQ-F4                31    1    1    1    1    1    1
tetracene               8    1    1    1    1    1    1
thiazolothiazolePh      8    1    1    1    1    1    1
TPP                     7    1    1    1    1    1    1
triazine               15    1    1    1    1    1    1
triphenylbenzene        8    0    1    0    1    0    1
triphenylene           11    1    1    1    1    1    1
triphenyltriazine      12    0    1    1    1    1    1
triptycene              3    0    1    0    1    0    1
TTAa                   58    1    1    1    1    1    1
TTAb                   51    1    1    1    1    1    1
TTF                     5    1    1    1    1    1    1
TTPa                    6    1    1    1    1    1    1
TTPb                   14    0    1    0    1    0    1
TTPc                   12    0    1    1    1    1    1
TTTT                   10    1    1    1    1    1    1