%chk=000216199.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216199

0 1
O 1.116880 -0.801086 1.392550
O -0.228873 -4.076750 -1.897331
O -0.258226 -4.972181 0.154937
O -1.172155 2.768695 -1.172268
O -2.521702 3.348301 1.129781
N 0.649059 -1.751406 -0.631835
N 1.608802 0.712510 -1.711807
C 2.873398 1.129139 0.460527
C 4.127651 1.850827 -0.069996
C 2.300001 0.110225 -0.539359
C -0.485951 -2.522255 -0.093432
C 1.293001 -0.806682 0.187889
C -1.859585 -2.014500 -0.587225
C 4.477597 3.026963 0.851084
C 5.316861 0.889291 -0.185027
C -2.096606 -0.604016 -0.125307
C -0.307536 -3.980508 -0.526795
C -1.596406 0.460050 -0.896736
C -2.771578 -0.351388 1.075283
C -1.740648 1.764054 -0.428200
C -2.949917 0.960819 1.534724
C -2.428906 2.013424 0.786534
H 2.094513 1.866298 0.737606
H 3.108109 0.612596 1.417150
H 3.906311 2.260791 -1.086821
H 3.133577 -0.543491 -0.922940
H -0.448165 -2.486472 1.040477
H -1.914829 -2.079563 -1.696419
H -2.659497 -2.690559 -0.218689
H 3.661461 3.754987 0.905518
H 5.367942 3.557876 0.496936
H 4.685860 2.691836 1.873801
H 5.096694 0.049901 -0.853364
H 5.589976 0.467151 0.789225
H 6.203929 1.398202 -0.577357
H 0.667249 -1.636798 -1.650804
H 0.934780 1.422707 -1.414845
H 2.281269 1.181252 -2.314276
H -1.085743 0.283627 -1.844792
H -3.155529 -1.177636 1.671978
H -3.475840 1.146709 2.467870
H -0.087013 -5.010836 -2.209495
H -1.384440 3.661739 -0.776785
H -2.972477 3.465856 2.000934


%chk=000216199-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216199

0 1
O 1.435124 -1.585464 1.414120
O 0.241016 -4.128543 -1.979537
O -1.661464 -4.673945 -0.769160
O -0.767774 3.175393 -0.451554
O -1.902493 3.411128 1.985405
N 0.585774 -1.759740 -0.763587
N 2.681436 -0.633237 -1.924198
C 2.517664 0.943531 0.018537
C 3.700867 1.888932 -0.321415
C 2.677176 -0.530354 -0.442364
C -0.627526 -2.466009 -0.402432
C 1.513245 -1.352570 0.167469
C -1.932867 -1.654977 -0.749803
C 3.328939 3.336199 0.083917
C 5.019755 1.448835 0.356697
C -1.985410 -0.325282 -0.020355
C -0.751008 -3.856605 -1.028658
C -1.394149 0.829423 -0.593017
C -2.580458 -0.229406 1.262036
C -1.382074 2.046553 0.109470
C -2.585001 0.995144 1.969799
C -1.981467 2.126829 1.393101
H 1.586460 1.351831 -0.423333
H 2.370508 0.929695 1.115231
H 3.864092 1.884284 -1.422298
H 3.603718 -0.941896 0.009248
H -0.592344 -2.608980 0.696423
H -1.962641 -1.500568 -1.845541
H -2.794351 -2.291312 -0.479331
H 2.391627 3.658536 -0.406696
H 4.129100 4.047405 -0.193129
H 3.179000 3.404875 1.178687
H 5.352503 0.450842 0.016690
H 4.894604 1.405585 1.455647
H 5.833382 2.164432 0.135353
H 0.842334 -1.518997 -1.734714
H 2.881915 0.252114 -2.398845
H 3.253922 -1.398588 -2.294141
H -0.930194 0.793701 -1.583797
H -3.038855 -1.114900 1.716177
H -3.049509 1.058844 2.961779
H 0.084919 -5.040351 -2.349552
H -0.861302 3.933452 0.184135
H -2.294894 3.423856 2.890433


