%chk=000237085.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237085

0 1
O 0.003651 -0.415539 -2.215154
N -1.886160 -0.948121 0.073673
C -0.426716 -0.634895 0.242804
C -2.638393 0.102423 -0.688717
C -2.544566 -1.206093 1.399186
C -4.071834 -0.383460 -0.957864
C -3.978992 -1.712253 1.170811
C -4.797130 -0.703713 0.355093
C 0.308852 -1.171788 -1.026656
C -0.125929 0.804561 0.614510
C 1.811708 -1.118890 -0.862154
C -0.086845 1.147708 1.976783
C 0.093268 1.799823 -0.346763
C 2.580753 -0.170329 -1.548100
C 2.439134 -2.047776 -0.017457
C 0.159674 2.466444 2.366128
C 0.342436 3.118086 0.045142
C 0.372982 3.456052 1.401098
C 3.968797 -0.144755 -1.384095
C 3.826260 -2.015904 0.145271
C 4.593018 -1.064402 -0.536122
H -0.046721 -1.287808 1.083768
H -2.109281 0.271595 -1.657510
H -2.659308 1.082508 -0.163148
H -2.559931 -0.303409 2.048174
H -1.958109 -1.985284 1.931415
H -4.043955 -1.288603 -1.596679
H -4.623632 0.386305 -1.527286
H -4.463063 -1.906803 2.144812
H -3.945633 -2.682951 0.636412
H -4.953314 0.222730 0.939761
H -5.804102 -1.109225 0.145926
H -0.030152 -2.221347 -1.217347
H -0.241411 0.385901 2.738138
H 0.086407 1.538237 -1.409721
H -0.964852 -0.499175 -2.410294
H 2.086923 0.540099 -2.214548
H 1.851806 -2.796547 0.509579
H 0.189288 2.723034 3.423376
H 0.516145 3.882445 -0.710250
H 0.566320 4.482354 1.704937
H 4.563022 0.594397 -1.918281
H 4.311321 -2.734820 0.802667
H 5.672965 -1.041715 -0.407218


%chk=000237085-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237085

0 1
O -0.298298 -1.144644 -1.862338
N -2.000316 -0.615834 0.063220
C -0.551466 -0.516971 0.502090
C -2.891348 0.509191 0.479818
C -2.606749 -1.927618 0.454999
C -4.272781 0.383603 -0.194031
C -3.984019 -2.127945 -0.208266
C -4.940265 -0.967723 0.144583
C 0.253381 -1.409142 -0.538003
C -0.054899 0.921276 0.587528
C 1.761501 -1.207431 -0.515186
C 0.224131 1.486341 1.856462
C 0.141961 1.720306 -0.570204
C 2.451026 -0.734661 -1.656042
C 2.498395 -1.535143 0.651062
C 0.679408 2.818968 1.976848
C 0.596238 3.051237 -0.453219
C 0.863609 3.608625 0.819566
C 3.855176 -0.575804 -1.625784
C 3.900539 -1.372280 0.683779
C 4.585328 -0.890114 -0.456712
H -0.429753 -0.976316 1.510220
H -2.417103 1.461538 0.197810
H -3.020804 0.516694 1.590419
H -2.715755 -1.980476 1.566962
H -1.926198 -2.741568 0.150764
H -4.144161 0.471004 -1.290846
H -4.909762 1.227508 0.133477
H -4.404799 -3.098317 0.118122
H -3.847982 -2.178899 -1.306154
H -5.174236 -1.000277 1.228925
H -5.899249 -1.076173 -0.395962
H 0.057759 -2.472902 -0.269356
H 0.086514 0.877211 2.758999
H -0.047133 1.284889 -1.557111
H -1.255256 -0.880575 -1.634798
H 1.872294 -0.508660 -2.556166
H 1.978817 -1.920234 1.538484
H 0.891910 3.236840 2.967421
H 0.749001 3.653310 -1.356297
H 1.217678 4.642089 0.906947
H 4.379585 -0.210176 -2.516360
H 4.458562 -1.624544 1.592944
H 5.674219 -0.767107 -0.434516


