%chk=000247672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247672

0 1
O 0.997260 -3.025202 0.370205
O -2.748836 -0.095011 0.634996
O 2.355360 0.752641 -0.532233
O -0.923012 -2.766186 1.543331
O -1.863855 -1.068023 -1.221164
N -0.277859 1.400456 0.182262
C 0.500928 -0.841630 1.007168
C -0.433420 0.136884 0.352864
C 0.846765 2.172318 0.582709
C 2.187890 1.924701 0.174435
C 0.580657 3.335698 1.325570
C 0.050423 -2.276987 1.023790
C -1.733649 -0.421610 -0.211305
C 3.218372 2.812570 0.500490
C 1.613673 4.213163 1.664736
C 2.922569 3.954192 1.251049
C 0.734798 -4.456270 0.187292
C -4.098988 -0.566634 0.302181
C -0.258911 -4.644379 -0.938051
C -4.671163 0.263550 -0.825579
C 3.625036 0.532206 -1.195654
H 1.503830 -0.770999 0.489822
H 0.694665 -0.520092 2.059150
H -0.446732 3.547468 1.631869
H 4.239704 2.624687 0.183080
H 1.391774 5.105687 2.247145
H 3.722964 4.646551 1.512218
H 1.748546 -4.822277 -0.055565
H 0.381554 -4.874091 1.146463
H -4.607246 -0.406086 1.271041
H -4.040646 -1.642646 0.061186
H 0.033261 -4.078475 -1.833932
H -1.259314 -4.281050 -0.654947
H -0.356790 -5.697965 -1.221352
H -5.734131 0.049998 -0.984506
H -4.569273 1.338890 -0.625308
H -4.146110 0.064653 -1.772927
H 3.836138 1.346566 -1.894830
H 4.420689 0.406257 -0.456700
H 3.429579 -0.405823 -1.734499


%chk=000247672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247672

0 1
O 1.023339 -3.317012 0.292774
O -2.779500 0.354402 0.136254
O 1.916639 1.433152 -1.041889
O -0.320232 -2.396543 1.968431
O -1.809959 -1.580272 -0.735257
N -0.309691 1.319905 0.689866
C 0.765164 -0.936506 0.294252
C -0.378434 0.071488 0.329421
C 0.868746 2.014294 1.043760
C 2.006855 2.128751 0.175524
C 0.867709 2.752585 2.256318
C 0.396895 -2.260381 0.950603
C -1.712511 -0.473297 -0.141232
C 3.107569 2.935582 0.547505
C 1.980630 3.527202 2.640709
C 3.100459 3.620709 1.783382
C 0.703923 -4.690824 0.795425
C -4.120730 -0.118768 -0.333067
C -0.568733 -5.212322 0.122726
C -4.354944 0.286692 -1.791006
C 2.971099 1.658172 -2.034216
H 1.083607 -1.115831 -0.745749
H 1.630825 -0.507836 0.831948
H -0.025945 2.691949 2.885063
H 3.973816 3.028778 -0.114449
H 1.965903 4.066380 3.593205
H 3.963530 4.233240 2.065341
H 1.593796 -5.281418 0.524376
H 0.592095 -4.646348 1.893182
H -4.818979 0.382434 0.355334
H -4.172882 -1.214397 -0.204350
H -0.461179 -5.212437 -0.975316
H -1.434265 -4.583291 0.388509
H -0.770408 -6.247481 0.456181
H -5.386043 0.020501 -2.089620
H -4.227130 1.375099 -1.919632
H -3.655235 -0.238766 -2.462144
H 3.048412 2.730617 -2.297061
H 3.950663 1.290413 -1.672096
H 2.661627 1.079082 -2.916501


