%chk=000264262.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264262

0 1
S 0.045947 -0.998145 0.588767
O 0.008842 -1.177081 2.031588
O 0.406134 -2.122184 -0.258416
N 1.108828 0.295045 0.227591
C 2.441521 0.057850 -0.433718
C 3.203691 1.396152 -0.208289
C 2.622538 2.005192 1.076271
C 1.217823 1.392022 1.238260
C 2.205013 -0.223104 -1.922477
C 3.201126 -1.110029 0.213889
C -1.492424 -0.370294 0.087089
C -2.474128 -0.100850 1.045389
C -1.752495 -0.151037 -1.267951
C -3.719285 0.395159 0.648159
C -2.997756 0.345779 -1.667647
C -3.979134 0.618363 -0.708757
H 3.048562 2.077061 -1.063358
H 4.289659 1.235713 -0.130960
H 3.257410 1.762888 1.946924
H 2.577817 3.104717 1.016631
H 1.060047 1.022694 2.275636
H 0.425844 2.139320 1.017780
H 3.151488 -0.287379 -2.467351
H 1.683034 -1.183621 -2.063460
H 1.595080 0.555719 -2.391283
H 2.689377 -2.072549 0.046765
H 4.204123 -1.218140 -0.209273
H 3.311585 -0.979912 1.295549
H -2.269439 -0.283950 2.107346
H -0.988223 -0.369241 -2.019608
H -4.485440 0.603435 1.392998
H -3.202587 0.516329 -2.723023
H -4.950579 1.004078 -1.019662


%chk=000264262-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264262

0 1
S 0.039616 -1.072696 0.359908
O 0.050238 -1.420428 1.963100
O 0.346672 -2.244224 -0.731220
N 1.146000 0.413957 -0.050824
C 2.576125 0.060132 -0.473458
C 3.224434 1.457951 -0.247888
C 2.617069 1.984039 1.079837
C 1.197887 1.348379 1.140839
C 2.596943 -0.353861 -1.957246
C 3.243079 -1.019272 0.421182
C -1.655970 -0.324731 -0.017458
C -2.491464 -0.028665 1.070180
C -2.021473 -0.145108 -1.361281
C -3.773965 0.498166 0.786947
C -3.306748 0.382452 -1.623849
C -4.175849 0.705276 -0.553423
H 2.952376 2.119721 -1.089746
H 4.324514 1.374870 -0.213193
H 3.223698 1.657679 1.942347
H 2.571144 3.085492 1.100486
H 1.037808 0.802940 2.091906
H 0.393939 2.095501 1.023200
H 3.641499 -0.420071 -2.314917
H 2.112367 -1.333993 -2.097919
H 2.063693 0.395650 -2.568649
H 2.744727 -1.995559 0.290509
H 4.303360 -1.136716 0.131430
H 3.203036 -0.750816 1.491701
H -2.151557 -0.225044 2.092529
H -1.335270 -0.417757 -2.168794
H -4.455006 0.738504 1.609992
H -3.627934 0.537047 -2.659194
H -5.170988 1.111187 -0.765632


