%chk=000215177.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215177

0 1
O -1.666523 0.156120 -0.539908
O -1.257002 3.291356 -0.546778
N -3.423624 3.432968 1.393108
C -0.241088 -0.122700 -0.409044
C -0.231461 -1.561298 0.132297
C 0.380684 0.891662 0.563075
C -2.020138 1.229427 -1.427265
C -2.448624 2.486963 -0.646782
C -0.298942 -2.581072 -0.969924
C 1.873712 0.766332 0.625724
C -3.008279 2.151962 0.748162
C -1.435216 -2.644078 -1.793510
C 2.491961 0.160463 1.730498
C 0.758892 -3.477227 -1.178997
C 2.665239 1.258285 -0.425349
C -1.512367 -3.597166 -2.809711
C 3.884224 0.046075 1.779819
C 0.675948 -4.430797 -2.198659
C 4.055536 1.139496 -0.371148
C -0.457444 -4.494353 -3.013924
C 4.668908 0.532573 0.730220
C -3.541117 3.302288 2.871660
H 0.231326 -0.054959 -1.413048
H -1.101226 -1.694440 0.814349
H 0.668689 -1.713884 0.762579
H -0.079414 0.789193 1.564361
H 0.094246 1.924888 0.231664
H -1.192514 1.474366 -2.118460
H -2.871693 0.810794 -1.996222
H -3.178145 3.079347 -1.247499
H -3.818603 1.398818 0.663223
H -2.206036 1.660254 1.345796
H -2.248319 -1.934298 -1.630873
H 1.889944 -0.217390 2.553520
H 1.647145 -3.431989 -0.552352
H 2.193357 1.738722 -1.280674
H -4.329179 3.729217 1.010380
H -1.382598 3.981899 0.150183
H -2.394905 -3.643745 -3.444757
H 4.358243 -0.423339 2.640084
H 1.499266 -5.125001 -2.356975
H 4.664122 1.522420 -1.188804
H -0.519746 -5.237501 -3.805082
H 5.751677 0.441913 0.770013
H -4.247592 2.532066 3.215047
H -3.856777 4.273756 3.287228
H -2.551247 3.074413 3.301658


%chk=000215177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215177

0 1
O -1.748853 -0.358773 0.195690
O -1.110757 2.386559 -0.888377
N -2.829342 3.704901 0.626947
C -0.266106 -0.440276 0.169977
C 0.133408 -1.937396 0.194838
C 0.287181 0.345429 1.388074
C -2.357505 0.266644 -0.980620
C -2.453146 1.797866 -0.886187
C -0.210225 -2.668492 -1.092592
C 1.786438 0.588414 1.296022
C -3.181064 2.277284 0.400332
C -1.476195 -3.285280 -1.269059
C 2.703659 -0.062541 2.159353
C 0.720663 -2.720535 -2.163694
C 2.294802 1.481191 0.313161
C -1.803503 -3.936607 -2.480150
C 4.094733 0.169789 2.049064
C 0.397655 -3.369549 -3.376990
C 3.682810 1.714030 0.199846
C -0.867348 -3.981545 -3.539666
C 4.589386 1.058760 1.067528
C -2.870263 4.163770 2.034006
H 0.101512 0.041163 -0.756020
H -0.384635 -2.400906 1.056088
H 1.221928 -1.994047 0.387414
H 0.028099 -0.197058 2.317062
H -0.247155 1.312402 1.393391
H -1.803199 -0.008118 -1.899724
H -3.378681 -0.156186 -1.048088
H -3.014084 2.148850 -1.786471
H -4.274772 2.091224 0.325282
H -2.793787 1.690661 1.252823
H -2.205209 -3.244176 -0.451322
H 2.325006 -0.750959 2.925638
H 1.706268 -2.253214 -2.041699
H 1.589631 1.992711 -0.354821
H -3.363394 4.330782 0.007972
H -1.247881 3.226902 -0.335241
H -2.785114 -4.410923 -2.596448
H 4.789241 -0.339625 2.727250
H 1.131536 -3.402996 -4.190654
H 4.059068 2.407783 -0.561129
H -1.118182 -4.489734 -4.477839
H 5.666647 1.241132 0.981014
H -3.868927 4.058147 2.514444
H -2.572043 5.225711 2.084974
H -2.145000 3.579632 2.627502


