%chk=000261309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261309

0 1
O 2.271540 1.569956 -1.810466
N -1.590947 0.487056 0.421031
N 1.181267 1.265057 0.171941
N 5.007744 -0.708966 1.150341
C -0.502923 -0.484303 0.765481
C -1.167616 1.396877 -0.696509
C 0.738337 0.312696 1.223201
C 0.087382 2.180217 -0.263570
C -2.863983 -0.158079 0.120768
C 2.193051 0.958735 -0.756832
C -4.038205 0.462227 0.611810
C -2.952814 -1.360068 -0.600532
C 3.217559 -0.049693 -0.341587
C -5.276448 -0.151591 0.368055
C -3.990328 1.748979 1.367755
C -4.194687 -1.956571 -0.826478
C -5.357219 -1.351493 -0.342057
C 3.419030 -1.196977 -1.119183
C 4.042231 0.168132 0.779523
C 4.412673 -2.104276 -0.743338
C 5.184201 -1.827296 0.397502
H -0.232761 -1.161643 -0.072496
H -0.865650 -1.123511 1.600557
H -1.999264 2.107175 -0.897865
H -0.972048 0.851031 -1.644795
H 0.489515 0.908802 2.133700
H 1.555288 -0.383412 1.504007
H 0.448794 2.818557 -1.104396
H -0.149888 2.851285 0.592428
H -2.053319 -1.832155 -0.990837
H -6.187856 0.314202 0.740780
H -4.811404 1.841521 2.089029
H -3.047676 1.853079 1.930875
H -4.048725 2.607862 0.684848
H -4.255364 -2.889912 -1.382609
H -6.326863 -1.813685 -0.517871
H 2.812753 -1.371358 -2.010196
H 3.934526 1.067893 1.399900
H 4.593491 -3.004240 -1.327035
H 5.975604 -2.509705 0.731519


%chk=000261309-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261309

0 1
O 2.425698 1.673015 -1.675015
N -1.704590 0.182059 0.248347
N 1.084924 0.877011 0.061533
N 4.894644 -0.915764 1.459017
C -0.667537 -0.848488 0.451078
C -1.251368 1.207742 -0.728706
C 0.634321 -0.195635 0.975102
C 0.040183 1.884876 -0.233792
C -3.074925 -0.243493 0.169858
C 2.262474 0.887676 -0.682980
C -4.125863 0.675244 0.499008
C -3.406106 -1.581180 -0.185254
C 3.390396 -0.024453 -0.267055
C -5.465208 0.222030 0.420901
C -3.835570 2.084387 0.985426
C -4.748656 -2.010832 -0.240177
C -5.789642 -1.102819 0.051655
C 4.171949 -0.642804 -1.275798
C 3.811038 -0.176365 1.080962
C 5.287635 -1.419652 -0.902708
C 5.605439 -1.537258 0.471457
H -0.431598 -1.401648 -0.491374
H -1.024000 -1.578618 1.198801
H -2.036011 1.968237 -0.860654
H -1.063706 0.742251 -1.724740
H 0.438232 0.233446 1.977595
H 1.414181 -0.966574 1.066079
H 0.440729 2.567130 -1.000656
H -0.175264 2.450729 0.693842
H -2.609242 -2.288188 -0.438612
H -6.269133 0.921536 0.682684
H -4.634576 2.432673 1.662772
H -2.872713 2.117284 1.526336
H -3.776255 2.816593 0.155450
H -4.977771 -3.045244 -0.520493
H -6.836302 -1.422819 0.008779
H 3.903967 -0.489131 -2.325897
H 3.281202 0.333550 1.894335
H 5.907229 -1.917831 -1.654647
H 6.460793 -2.136268 0.803941


