%chk=000275035.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275035

0 1
O -1.263519 0.753102 1.040093
O 0.965871 0.440092 2.048759
O -0.552856 1.251551 -1.048689
N -4.774739 0.791401 -0.176972
C 1.011746 0.245075 0.627583
C 1.156537 -1.230556 0.302380
C 2.166237 1.092550 0.121212
C -3.368746 0.287168 -0.101886
C 2.209677 -1.983473 0.869707
C -0.314406 0.824370 0.052170
C -2.597702 1.287802 0.769069
C 0.259612 -1.866404 -0.568993
C -4.965712 1.669409 -1.381071
C -5.775025 -0.325673 -0.142821
C 2.320437 -3.350868 0.570794
C 1.411373 -3.978553 -0.288831
C 0.377277 -3.222612 -0.865046
C 2.613945 0.935218 -1.198440
C 2.773951 2.033592 0.962978
C 3.225215 -1.360315 1.767049
C -6.184986 2.569568 -1.177997
C -5.841283 -0.929714 1.260456
C 3.673289 1.715318 -1.668774
C 3.835205 2.808413 0.487282
C 1.552038 -5.431255 -0.606125
C 4.285700 2.650095 -0.827157
H -2.873144 0.182586 -1.092024
H -3.327761 -0.718276 0.371048
H -3.011653 1.378022 1.789542
H -2.496913 2.279971 0.299521
H -0.548704 -1.303138 -1.040810
H -4.059409 2.305921 -1.499956
H -5.067965 1.090176 -2.323986
H -6.771257 0.100327 -0.402573
H -5.562902 -1.117242 -0.893278
H 3.130534 -3.928733 1.011658
H -0.329808 -3.692149 -1.544233
H 2.129962 0.212793 -1.856938
H 2.413897 2.153600 1.988015
H 3.926787 -0.738572 1.187187
H 2.757319 -0.683960 2.505635
H 3.817970 -2.093812 2.324516
H 0.177841 -0.021471 2.432431
H -6.244666 3.331285 -1.962148
H -6.133630 3.085578 -0.209289
H -7.122322 2.002217 -1.186799
H -6.671318 -1.638321 1.344421
H -5.988941 -0.145906 2.016149
H -4.919172 -1.458652 1.526502
H 4.018835 1.596558 -2.694200
H 4.307755 3.538840 1.141403
H 1.951638 -6.005796 0.240646
H 0.596850 -5.894899 -0.886237
H 2.242887 -5.577649 -1.450562
H 5.110353 3.256798 -1.196969


%chk=000275035-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000275035

0 1
O -1.274262 0.730989 1.240659
O 1.046424 0.251255 2.226359
O -0.538577 1.215935 -0.915582
N -4.804835 0.649960 -0.119734
C 1.043621 0.201692 0.752456
C 1.209452 -1.262462 0.264886
C 2.170835 1.130037 0.256262
C -3.503341 0.092804 0.311403
C 2.338246 -2.037534 0.691651
C -0.308490 0.781520 0.230577
C -2.643989 1.229475 0.894845
C 0.251384 -1.866910 -0.583212
C -4.775118 1.167368 -1.516951
C -5.967368 -0.229603 0.169998
C 2.433492 -3.380747 0.256864
C 1.471787 -3.993320 -0.586743
C 0.374122 -3.208847 -1.005357
C 2.629396 1.037576 -1.079833
C 2.716433 2.112258 1.115301
C 3.438521 -1.479021 1.577330
C -5.784804 2.304640 -1.760596
C -6.332369 -0.266300 1.666087
C 3.631621 1.914470 -1.549115
C 3.720821 2.987863 0.644577
C 1.624138 -5.441730 -1.017549
C 4.181833 2.893036 -0.688528
H -2.952893 -0.397709 -0.525072
H -3.661956 -0.675096 1.088711
H -3.058581 1.595096 1.845710
H -2.540475 2.059368 0.175276
H -0.603355 -1.286748 -0.947081
H -3.755702 1.548458 -1.714283
H -4.947671 0.342556 -2.253034
H -6.832109 0.166581 -0.392281
H -5.796403 -1.270316 -0.204635
H 3.297942 -3.971055 0.588986
H -0.387084 -3.642390 -1.664856
H 2.203712 0.282698 -1.749063
H 2.360075 2.165870 2.147457
H 4.036198 -0.720505 1.038673
H 3.018234 -0.978186 2.464581
H 4.121513 -2.282714 1.902244
H 0.117603 0.066014 2.525382
H -5.707621 2.670074 -2.801520
H -5.584507 3.145831 -1.074427
H -6.827155 1.974887 -1.598936
H -7.212528 -0.914672 1.833592
H -6.567317 0.750972 2.024522
H -5.505251 -0.662973 2.283151
H 3.981035 1.835399 -2.584742
H 4.143294 3.741853 1.318678
H 1.570407 -6.126364 -0.149729
H 0.832504 -5.736846 -1.727573
H 2.600591 -5.615533 -1.507098
H 4.960725 3.572443 -1.053286


