%chk=000114985.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000114985

0 1
N -1.617552 -1.317118 -0.843978
N -3.087963 -3.012251 -0.531603
C 2.523970 -1.719611 1.394824
C 1.323077 -2.092624 0.562665
C -1.131434 -2.087828 0.231571
C -1.015306 -0.080706 -1.370537
C 3.449780 -0.719252 0.683433
C 0.082374 -1.766284 0.964272
C -1.483033 1.127038 -0.589362
C 1.604973 -2.830467 -0.705878
C -2.825877 -1.912218 -1.268849
C -2.052828 -3.129072 0.397831
C 2.795999 0.598296 0.401251
C 3.425380 1.642906 -0.160257
C -0.707107 1.616668 0.469786
C -2.691213 1.756597 -0.919975
C -1.132667 2.736306 1.188869
C -3.113458 2.876028 -0.197242
C 2.719416 2.937269 -0.422594
C 4.867340 1.599809 -0.563454
C -2.335116 3.368286 0.855609
H 2.211998 -1.299048 2.373343
H 3.095559 -2.637876 1.644377
H -1.272688 0.023390 -2.450454
H 0.099205 -0.172069 -1.323644
H 4.352586 -0.561062 1.312406
H 3.822775 -1.162300 -0.264453
H -0.098653 -1.237288 1.903742
H 1.979373 -2.148522 -1.482142
H 0.707741 -3.323949 -1.110839
H 2.362460 -3.612613 -0.565902
H -3.428756 -1.528169 -2.073215
H 1.740083 0.666806 0.685250
H -2.029528 -3.931309 1.111762
H 0.232835 1.116240 0.737396
H -3.306343 1.371480 -1.731072
H -0.529476 3.113578 2.013244
H -4.053545 3.362943 -0.452783
H 3.183876 3.759529 0.139286
H 1.658085 2.914704 -0.141207
H 2.762901 3.204336 -1.487358
H 5.514773 1.398248 0.301698
H 5.212773 2.539658 -1.010797
H 5.051484 0.804993 -1.299446
H -2.667376 4.239227 1.417627


%chk=000114985-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114985

0 1
N -1.353075 -1.244064 -0.254135
N -3.094509 -2.535616 0.423804
C 3.087240 -2.255127 0.938253
C 1.693939 -2.322172 0.332520
C -0.822311 -2.163962 0.688990
C -0.632215 -0.130627 -0.899805
C 3.905303 -1.002020 0.475921
C 0.583236 -2.200615 1.125604
C -1.261932 1.237898 -0.654933
C 1.626928 -2.545633 -1.167210
C -2.714375 -1.515122 -0.371441
C -1.927001 -2.932603 1.090429
C 3.296360 0.301233 0.951235
C 2.930312 1.391961 0.216264
C -1.783184 1.587876 0.616195
C -1.268165 2.204115 -1.690356
C -2.294572 2.883355 0.846426
C -1.776956 3.503311 -1.460666
C 2.332997 2.619893 0.887194
C 3.071627 1.509164 -1.292403
C -2.290403 3.847465 -0.189717
H 3.017560 -2.244136 2.043255
H 3.662326 -3.161195 0.654613
H -0.554757 -0.318362 -1.987883
H 0.394578 -0.138873 -0.489964
H 4.927628 -1.103547 0.896938
H 4.021781 -1.019382 -0.622936
H 0.737608 -2.132677 2.212243
H 1.974128 -1.659489 -1.735339
H 0.604591 -2.788491 -1.501245
H 2.291917 -3.383131 -1.453757
H -3.374314 -0.939075 -1.015810
H 3.134572 0.352201 2.040611
H -1.935708 -3.760110 1.796648
H -1.794501 0.842299 1.419696
H -0.880651 1.939752 -2.682802
H -2.698374 3.141240 1.831847
H -1.779240 4.239813 -2.272016
H 2.939078 3.523223 0.674435
H 2.271222 2.499372 1.982708
H 1.312502 2.825124 0.506511
H 3.753353 2.342431 -1.555046
H 2.092799 1.750689 -1.754273
H 3.462865 0.594432 -1.767644
H -2.689310 4.851881 -0.009757


