%chk=000265053.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265053

0 1
P 3.979177 0.377702 0.117178
O 4.104168 1.787094 -0.699492
O 5.391544 -0.414138 -0.211093
O 3.597667 0.596843 1.520080
O -7.512216 -0.352011 0.482666
O -6.667569 0.929186 2.004510
N 2.947123 -0.652511 -0.852597
N -6.565218 0.170608 1.052272
C -1.499144 0.638999 1.203208
C -0.533864 -0.044690 0.261542
C -1.249598 -0.851784 -0.678524
C -2.845241 0.157931 0.718584
C -2.677883 -0.728368 -0.400744
C 0.843633 0.038276 0.243989
C -0.555985 -1.584525 -1.635692
C 1.541279 -0.702008 -0.745235
C -4.100771 0.458416 1.201209
C -3.781720 -1.302536 -1.021161
C 0.838168 -1.511485 -1.670559
C -5.211277 -0.135228 0.556047
C -5.061084 -1.000583 -0.534909
C 4.365566 1.806921 -2.125378
C 6.179497 -0.850370 0.933492
C 5.794690 1.413155 -2.442620
C 6.771230 0.321166 1.691408
H -1.311018 0.357694 2.259031
H -1.408336 1.742462 1.157234
H 1.366267 0.637076 0.996655
H -1.089791 -2.208698 -2.351841
H -4.257593 1.128642 2.050859
H -3.661373 -1.974456 -1.868224
H 1.381311 -2.083854 -2.417030
H -5.949290 -1.438468 -1.004015
H 3.375880 -1.313460 -1.522363
H 3.618033 1.193642 -2.660354
H 4.175208 2.880819 -2.343839
H 5.564589 -1.507288 1.577935
H 6.957686 -1.454058 0.421644
H 6.039645 1.615795 -3.491925
H 6.507909 1.975410 -1.822345
H 5.999614 0.347910 -2.255043
H 7.587901 -0.003972 2.348107
H 7.180165 1.082657 1.013723
H 6.029924 0.823887 2.336210


%chk=000265053-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265053

0 1
P 4.065925 -0.107951 0.522931
O 3.927494 1.510582 -0.068904
O 5.510586 -0.836626 -0.105332
O 3.917183 -0.108413 2.101573
O -7.612887 -0.019654 -0.018251
O -6.748813 1.453978 1.495694
N 2.999191 -1.071963 -0.465419
N -6.614978 0.537569 0.590172
C -1.515566 0.744248 1.077661
C -0.529393 -0.101963 0.282203
C -1.237076 -0.961881 -0.615021
C -2.865804 0.285197 0.541509
C -2.675813 -0.725212 -0.458498
C 0.869133 -0.118205 0.354240
C -0.522015 -1.851978 -1.448525
C 1.586411 -1.013110 -0.490821
C -4.150231 0.709583 0.896314
C -3.789917 -1.312785 -1.105751
C 0.883407 -1.873678 -1.385703
C -5.250068 0.106623 0.233594
C -5.087183 -0.893396 -0.756606
C 3.824086 1.807520 -1.529105
C 6.690954 -0.923495 0.811608
C 5.194977 1.839979 -2.209649
C 7.365905 0.434683 1.014578
H -1.422421 0.569295 2.167057
H -1.353915 1.828137 0.919476
H 1.401764 0.526142 1.062735
H -1.044045 -2.522476 -2.139822
H -4.336735 1.475769 1.653645
H -3.653872 -2.085568 -1.869314
H 1.449180 -2.558592 -2.028656
H -5.977373 -1.317754 -1.227957
H 3.461711 -1.818602 -0.989547
H 3.147537 1.072264 -2.005461
H 3.339752 2.798122 -1.540172
H 6.359204 -1.354378 1.774504
H 7.348026 -1.640047 0.292471
H 5.078411 2.160259 -3.262298
H 5.862259 2.558265 -1.702851
H 5.671981 0.845078 -2.195569
H 8.283203 0.304425 1.618654
H 7.647528 0.885455 0.047549
H 6.701201 1.132355 1.553666


