%nprocshared=12
%mem=20GB
#p opt freq=NoRaman genecp scf=xqc scrf=(solvent=tetrahydrofuran,smd) nosymm guess=always Int=(grid=UltraFine) empiricaldispersion=gd3 b3lyp

LSS

0 1
 C	 2.455293000	 1.843137000	 9.450448000
 C	 5.583235000	 4.142689000	 6.942734000
 N	 3.387847000	 3.509873000	 7.881114000
 C	 6.299890000	 4.697331000	 5.879996000
 H	 5.863912000	 4.704123000	 4.883440000
 O	 3.754477000	 1.322397000	 7.462041000
 C	 7.412306000	 4.698043000	 8.426156000
 H	 7.840523000	 4.700688000	 9.424522000
 C	 8.124419000	 5.245230000	 7.360905000
 H	 9.108486000	 5.674571000	 7.524337000
 C	 7.564234000	 5.243795000	 6.084986000
 H	 8.108977000	 5.673656000	 5.249405000
 C	 4.234154000	 3.496419000	 6.683949000
 H	 3.732816000	 4.042041000	 5.878068000
 C	 6.148834000	 4.148684000	 8.219488000
 H	 5.590585000	 3.735165000	 9.054746000
 C	 4.339485000	 1.986508000	 6.326383000
 H	 3.757618000	 1.719487000	 5.440792000
 H	 5.365869000	 1.633111000	 6.215538000
 C	 3.228314000	 2.297971000	 8.231980000
 C	 0.978198000	 1.680534000	 9.059786000
 H	 0.395597000	 1.355953000	 9.926160000
 H	 0.888704000	 0.926474000	 8.271916000
 H	 0.565920000	 2.625359000	 8.698947000
 C	 1.837369000	 4.148511000	 13.431371000
 N	 1.686662000	 3.613852000	 11.016155000
 C	 1.737419000	 5.164610000	 14.383586000
 H	 1.956071000	 6.191019000	 14.097998000
 O	 3.882840000	 3.095859000	 10.937781000
 C	 1.163849000	 2.546000000	 15.116888000
 H	 0.935842000	 1.521523000	 15.396616000
 C	 1.070554000	 3.565111000	 16.062970000
 H	 0.770861000	 3.338557000	 17.081877000
 C	 1.358244000	 4.876857000	 15.692726000
 H	 1.282298000	 5.678586000	 16.421469000
 C	 2.316474000	 4.471499000	 12.028908000
 H	 2.074049000	 5.515759000	 11.809015000
 C	 1.545681000	 2.836484000	 13.809845000
 H	 1.604661000	 2.040252000	 13.073304000
 C	 3.837765000	 4.220977000	 11.829870000
 H	 4.341949000	 5.059758000	 11.342936000
 H	 4.362768000	 3.953553000	 12.748276000
 C	 2.613659000	 2.915213000	 10.500028000
 C	 3.015490000	 0.517930000	 10.000064000
 H	 2.891847000	-0.276742000	 9.260760000
 H	 2.466275000	 0.238912000	 10.904753000
 H	 4.076049000	 0.603299000	 10.247863000

-C -N -O -H -S -F 0
6-31g(d)
****
-Cu 0
LANL2DZ
****

-Cu 0
LANL2DZ

