g'Gg-1,2-Propanediol Tue May 23 13:55:18 2017 12 597 3 0 0.0000E+000 1.0000E+003 1.0000E+000 1.0000000000 s 1 1 0 125 0 1 1 1 0 1 0 10099 6.627614630756509E+003 1.73878325E-004 /A 20099 4.146280933498148E+003 1.01113858E-004 /B 30099 3.363349569209154E+003 1.05123006E-004 /C 2099 5.643487451690989E-003 6.85201077E-007 /-DK 1199 -7.053730016378899E-003 5.03313252E-007 /-DJK 299 -1.713483104773032E-003 5.58042290E-008 /-DJ 40199 -2.608876395136831E-004 2.69649544E-008 /d1 50099 -5.003126193416600E-005 1.46223665E-008 /d2 3099 -9.188552704008006E-008 5.14953592E-010 /HK 2199 1.324777158736067E-007 7.55228815E-010 /HKJ 1299 -3.534829124486137E-008 3.46883557E-010 /HJK 60099 1.033921520114346E-010 9.16916118E-012 /h3 0.2511061-0.0204897-0.3399180 0.0489737-0.1747722-0.5003972-0.3827512-0.0807697 -0.0216362 0.1309232 0.4640094 0.1667277 0.2854274 0.1463528-0.2541025 0.0840711 0.7043105 0.4638517-0.1300253 0.2260837-0.8313068 0.1299339-0.4723083 0.5185479 0.0248602-0.0570468-0.0246414 0.9270145-0.0368472-0.0475739-0.0890448-0.0727624 0.0915021-0.0370140-0.2317750 0.7395151-0.3441357-0.1444969-0.1668307 0.6984403 -0.1772104 0.1990855-0.0668786-0.1281127-0.6632933 0.5393722-0.0617562 0.2557078 -0.0241881-0.4909832 0.0686590 0.1998624-0.2538545-0.6317578 0.6068773 0.3669580 0.2564086 0.2647039 0.6709048-0.7737796-0.5051197-0.0786911 0.1556656 0.3974619 -0.7935342 0.9999844-0.0548263 0.0880812-0.1113524-0.0101905 0.0385779 0.0863525 -0.1905637-0.5899412 0.0542966-0.0447598-0.0055804 1.0000000