Orca 5.0.3 RELEASE 136.0618 AuxInfo=1/0/N:8,4,3,1,12,2,7;15,19,14,13/E:;(1,2)/CRV:3.3,4.1,5.1,7.2;3.3,4.1/rA:22nO1OC3CHHH2CHHHO1O1C3CHHHCHHH/rB:s1;s2;s3;s4;s4;s4;s3;s8;s8;s8;s7;;s13;s14;s15;s15;s15;s14;s19;s19;s19;/rC:-4.0931,1.566,1.2432;-3.5786,.9399,.2051;-2.7008,.0766,.4227;-2.1265,-.5622,-.756;-2.7476,-.3675,-1.6429;-1.9314,-1.6294,-.6224;-1.1156,.0041,-1.1248;-2.3182,-.1818,1.8038;-3.2282,-.4348,2.3694;-1.9923,.779,2.2307;-1.5315,-.9376,1.8733;-.239,.0987,-.2791;1.3299,.6599,.3474;2.2882,.2484,-.2718;3.6501,.6715,.1403;3.5917,1.4095,.9476;4.189,1.0884,-.722;4.2138,-.2095,.4794;2.1355,-.656,-1.435;1.8371,-.0425,-2.2981;1.3015,-1.3379,-1.2347;3.0659,-1.1828,-1.6762; Charge 0 Mult 1 dlpno-ccsd(t) cc-pvtz 136.0618 AuxInfo=1/0/N:8,4,3,1,12,2,7;15,19,14,13/E:;(1,2)/CRV:3.3,4.1,5.1,7.2;3.3,4.1/rA:22nO1OC3CHHH2CHHHO1O1C3CHHHCHHH/rB:s1;s2;s3;s4;s4;s4;s3;s8;s8;s8;s7;;s13;s14;s15;s15;s15;s14;s19;s19;s19;/rC:-4.0931,1.566,1.2432;-3.5786,.9399,.2051;-2.7008,.0766,.4227;-2.1265,-.5622,-.756;-2.7476,-.3675,-1.6429;-1.9314,-1.6294,-.6224;-1.1156,.0041,-1.1248;-2.3182,-.1818,1.8038;-3.2282,-.4348,2.3694;-1.9923,.779,2.2307;-1.5315,-.9376,1.8733;-.239,.0987,-.2791;1.3299,.6599,.3474;2.2882,.2484,-.2718;3.6501,.6715,.1403;3.5917,1.4095,.9476;4.189,1.0884,-.722;4.2138,-.2095,.4794;2.1355,-.656,-1.435;1.8371,-.0425,-2.2981;1.3015,-1.3379,-1.2347;3.0659,-1.1828,-1.6762; Epsilon 80.4 Refrac 1.33 Overall time for CPCM initialization 0.0s -1406260.3740166859