%mem=185GB
%nprocshared=36
%chk=Bpin_m2_m1_TS_IRC1_1_p.chk
#p opt freq b3lyp/genecp scrf=(solvent=thf,pcm) empiricaldispersion=gd3bj
scf=xqc

Bpin_m2_m1_TS_IRC1_1_p

0 1
 C                 -0.09721500    0.43767200   -0.20916300
 C                 -1.07395900    3.80076400    1.17364700
 C                 -2.18994400    3.57293800    0.09195300
 B                 -0.71134600    1.85081100    0.07852800
 O                 -1.99020800    2.16882600   -0.26508000
 O                 -0.05023900    2.83279900    0.76776400
 C                 -1.96837100    4.38356700   -1.18686100
 H                 -2.64928900    4.01688500   -1.96026400
 H                 -2.16910900    5.44674200   -1.02341900
 H                 -0.94292200    4.27655300   -1.55452900
 C                 -3.61686800    3.74421800    0.59415200
 H                 -3.78120500    4.77122200    0.93798500
 H                 -4.31817200    3.53810000   -0.21953700
 H                 -3.83845600    3.05764300    1.41310300
 C                 -0.45324800    5.19015600    1.18146600
 H                 -1.21111400    5.94607100    1.41267100
 H                  0.32406400    5.24226500    1.95039800
 H                  0.00013700    5.43407700    0.21828000
 C                 -1.50892900    3.38930100    2.58287700
 H                 -0.63280800    3.39003000    3.23868900
 H                 -2.24724200    4.08528200    2.99186700
 H                 -1.93580400    2.38160400    2.58307300
 C                  0.31299300   -1.35570100   -2.08019000
 C                 -1.01930900   -1.66832800   -2.78158900
 C                 -1.30881200   -0.67061600   -3.91220900
 C                 -1.25181200    0.78064400   -3.41227700
 C                  0.08738100    1.07634000   -2.71761200
 C                  0.30944800    0.07826700   -1.60045800
 H                  0.48847000   -2.03330300   -1.24316100
 H                 -0.99608600   -2.69284800   -3.17121400
 H                 -0.57275600   -0.80642400   -4.71856700
 H                 -1.39679700    1.47947800   -4.24442600
 H                  0.91364100    0.97897200   -3.43571800
 O                  1.32195800    0.44045900   -0.64227800
 H                  0.11613600    2.10043400   -2.32998700
 H                 -2.06381100    0.95528800   -2.69738100
 H                 -2.29695500   -0.87571700   -4.34001800
 H                 -1.83581800   -1.62208900   -2.04988300
 H                  1.14407500   -1.47461900   -2.79038300
 C                 -0.81244400   -2.63274600    1.90434100
 C                 -1.67675100   -1.52370200    2.61045300
 B                 -0.51355700   -0.64041800    0.85286700
 O                 -1.58335900   -0.41007300    1.66587300
 O                  0.11199900   -1.83721700    1.08231400
 C                 -1.08292000   -1.02662900    3.92928100
 H                 -1.62874900   -0.13351400    4.24732300
 H                 -1.17504200   -1.78388300    4.71366500
 H                 -0.02839400   -0.76122800    3.82441600
 C                 -3.14606500   -1.88336800    2.79116600
 H                 -3.24389100   -2.78208400    3.41019000
 H                 -3.66214700   -1.06319100    3.29958600
 H                 -3.64040400   -2.04856100    1.83218600
 C                  0.00250700   -3.50884300    2.84540400
 H                 -0.66211600   -4.06090500    3.51790200
 H                  0.57766100   -4.23855300    2.26693700
 H                  0.69753300   -2.92280400    3.45053000
 C                 -1.61503600   -3.49290600    0.92629700
 H                 -0.92019100   -4.09149600    0.32902700
 H                 -2.28512200   -4.17387500    1.45925700
 H                 -2.21680900   -2.87804500    0.24991700

C H O B 
6-31G(d)
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