94
TADF 4CzIPN T_1 State Structure at LCY-PBE/TZP/GoodQuality level, E(T_1) = -33.67699976 a.u.
C         0.013636   -3.939017   -1.111654
C         0.732760   -3.542650    0.010634
C         1.654337   -4.395238    0.650079
C         1.850396   -5.680357    0.157839
C         1.131420   -6.087109   -0.957051
C         0.226263   -5.224238   -1.584219
C         2.219534   -3.646672    1.748959
C         1.614605   -2.375234    1.729785
N         0.724823   -2.312627    0.654823
C         3.141629   -3.953023    2.744144
C         3.438988   -2.992528    3.699578
C         2.812132   -1.743354    3.677236
C         1.886154   -1.417562    2.697064
C        -0.032338   -1.207664    0.253672
C        -1.471251   -1.285573    0.310998
C        -2.236341   -0.145579    0.013944
C        -1.622237    1.083116   -0.290084
C        -0.184695    1.186342   -0.247982
C         0.573734    0.033138   -0.001685
C        -2.367882    2.132180   -0.853868
N        -2.966804    3.017002   -1.316594
N        -3.619856   -0.232704    0.019257
N         1.965465    0.117671   -0.014237
C         2.824664   -0.692525   -0.763187
C         4.150397   -0.292713   -0.518787
C         4.093863    0.799973    0.432101
C         2.734864    1.029812    0.712331
C         5.186795   -0.914512   -1.194676
C         4.880154   -1.919196   -2.107695
C         3.557802   -2.278765   -2.364672
C         2.504091   -1.659373   -1.706160
C         2.320356    1.953068    1.662929
C         3.304326    2.703741    2.291244
C         4.654246    2.514286    1.997161
C         5.060875    1.552326    1.077312
C        -2.074331   -2.420138    0.880642
N         0.420290    2.383741   -0.641926
H         1.267839    2.085719    1.911595
H         3.012092    3.449178    3.030546
H         5.403158    3.117780    2.510089
H         6.120050    1.386776    0.878576
H         3.341783   -3.054594   -3.098936
H         5.685051   -2.421447   -2.644459
H         6.221400   -0.615178   -1.025040
H         1.470016   -1.922314   -1.927159
H         1.382606   -0.450418    2.698917
H         3.048407   -1.010010    4.448797
H         4.160242   -3.216172    4.485886
H         3.616458   -4.934623    2.776961
H         2.559291   -6.356886    0.637152
H         1.271597   -7.093429   -1.352308
H        -0.325796   -5.570353   -2.458299
H        -0.694499   -3.264425   -1.595653
N        -2.547753   -3.375337    1.348471
C         1.287170    2.574107   -1.719651
C         1.718177    3.914927   -1.728057
C         1.068261    4.570354   -0.616897
C         0.271717    3.597326    0.017613
C        -0.482641    3.882582    1.150190
C         1.100142    5.864136   -0.108521
C         2.586306    4.350514   -2.723907
C         1.679914    1.670195   -2.697281
C        -0.434529    5.178585    1.638671
C         0.344889    6.160031    1.017024
H        -1.091936    3.115454    1.630873
H        -1.018947    5.438644    2.521569
H         0.356677    7.170869    1.425261
H         1.711084    6.632744   -0.583879
C         3.003074    3.447809   -3.690630
C         2.548771    2.125653   -3.677829
H         2.926543    5.386740   -2.748160
H         3.683689    3.772913   -4.477763
H         2.876533    1.437690   -4.457713
H         1.310686    0.644244   -2.706801
C        -4.382424   -1.203005   -0.645724
C        -5.743432   -0.951842   -0.400123
C        -5.813510    0.207486    0.462009
C        -4.493635    0.632039    0.693150
C        -4.200142    1.696998    1.533222
C        -6.868337    0.884038    1.060116
C        -6.708762   -1.756561   -0.990718
C        -3.963288   -2.219672   -1.492422
C        -6.298612   -2.791012   -1.820153
C        -4.942948   -3.013038   -2.070462
H        -2.906640   -2.391834   -1.694223
H        -4.645799   -3.825466   -2.733524
H        -7.042565   -3.434237   -2.290383
H        -7.768931   -1.572954   -0.812680
C        -5.267874    2.360323    2.119155
C        -6.586210    1.965123    1.883456
H        -3.172457    2.004433    1.723469
H        -5.071019    3.206564    2.777255
H        -7.401914    2.509216    2.359837
H        -7.897838    0.565408    0.892876
