%chk=000194262.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194262

0 1
O -4.584476 -2.494145 -0.725662
N -1.397927 1.777786 -0.046192
N 4.307612 -0.174608 -0.739985
N -3.334497 -2.737629 1.139581
C -0.270901 -0.379764 0.337633
C -0.048705 1.155750 0.116067
C -1.053809 -1.003126 -0.831790
C -2.383491 -0.270995 -1.078877
C -2.132577 1.247345 -1.238518
C 0.958221 1.501832 -1.027234
C 1.046387 -1.099525 0.506947
C 2.216127 0.741220 -0.837194
C 2.160339 -0.492726 -0.097556
C -1.359682 3.276964 -0.058118
C -3.411597 -0.522134 0.041923
C 3.467555 -1.053150 -0.040480
C 1.263054 -2.292682 1.176449
C 3.531764 0.919579 -1.220944
C -1.064852 3.793817 1.361489
C 3.676715 -2.271766 0.643371
C 2.568696 -2.858752 1.233690
C -3.833197 -1.971923 0.081378
C -1.127468 5.316840 1.417917
H -0.875201 -0.484830 1.273591
H 0.383410 1.565708 1.069752
H -0.435415 -0.968035 -1.751373
H -1.229887 -2.078319 -0.640495
H -2.822307 -0.650219 -2.038277
H -1.593655 1.429970 -2.193730
H -3.105209 1.780177 -1.314866
H 1.142540 2.593207 -1.040631
H 0.517262 1.249899 -2.014138
H -0.621205 3.688977 -0.778324
H -2.356688 3.650639 -0.380611
H -4.318486 0.095119 -0.138545
H -3.007139 -0.154689 1.007517
H 0.447193 -2.815879 1.663735
H 3.986896 1.711243 -1.784426
H -1.792588 3.352719 2.072525
H -0.069254 3.441661 1.697527
H 5.289930 -0.285495 -0.884083
H 4.660036 -2.722142 0.700815
H 2.689383 -3.800165 1.771032
H -0.398949 5.780450 0.743329
H -2.119178 5.693562 1.141996
H -0.912408 5.681197 2.429530
H -2.650769 -2.397940 1.788896
H -3.567006 -3.716422 1.201360


%chk=000194262-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194262

0 1
O -4.147429 -2.733636 -0.931803
N -1.399922 1.759687 -0.073028
N 4.378805 -0.106762 -0.658623
N -3.715139 -2.649706 1.343947
C -0.247185 -0.417542 0.266634
C -0.057591 1.132090 0.094779
C -1.057831 -1.011990 -0.921143
C -2.411727 -0.282544 -1.116577
C -2.159476 1.237355 -1.238452
C 0.983835 1.528010 -1.025005
C 1.090730 -1.124767 0.444116
C 2.271021 0.772481 -0.803152
C 2.222325 -0.486417 -0.107807
C -1.424411 3.242330 -0.005112
C -3.430611 -0.580702 0.017270
C 3.538389 -1.030821 -0.021700
C 1.310565 -2.355874 1.093291
C 3.609122 0.985917 -1.128103
C -0.872334 3.822140 1.314066
C 3.759799 -2.270378 0.623464
C 2.625736 -2.913596 1.172297
C -3.792015 -2.066792 0.086186
C -1.121216 5.342986 1.414889
H -0.847464 -0.552759 1.188535
H 0.358039 1.499449 1.052314
H -0.458983 -0.925889 -1.849317
H -1.219259 -2.094184 -0.760104
H -2.866210 -0.641658 -2.060485
H -1.641881 1.439727 -2.210023
H -3.126366 1.776036 -1.277626
H 1.144657 2.622695 -1.003446
H 0.563665 1.290672 -2.023306
H -0.884954 3.720604 -0.863648
H -2.485275 3.549593 -0.099407
H -4.367294 -0.031807 -0.204752
H -3.054129 -0.196366 0.981864
H 0.472202 -2.899610 1.546081
H 4.086595 1.812246 -1.652243
H -1.358816 3.298260 2.159728
H 0.214658 3.627934 1.397689
H 5.386836 -0.194788 -0.763418
H 4.754254 -2.722473 0.706755
H 2.761316 -3.874718 1.681969
H -0.654558 5.881219 0.567854
H -2.203528 5.572368 1.402789
H -0.699248 5.755743 2.349009
H -3.425424 -2.121972 2.164952
H -3.967677 -3.633191 1.443801


