ClClO2, 4 isotopomers Thu Sep 8 16:28:58 2011 186 2346 3 0 0.0000E+00 1.0000E+01 1.0000E+00 1.0000000000 4 'a' 1 8 0 50 1 3 1 1 -1 1 'a' 44 0 0 50 1 3 1 1 -1 1 'a' 44 1 0 50 1 3 1 1 -1 1 'a' 44 2 0 50 1 3 1 1 -1 1 'a' 44 3 0 50 1 3 1 1 0 1 10000 9.450929481112531E+03 1.00000000E+17 -10044 9.450929481112531E+03 1.00000000E-37 20000 3.588057773184153E+03 1.00000000E+17 -20044 3.588057773184152E+03 1.00000000E-37 30000 2.787937680621852E+03 1.00000000E+17 -30044 2.787937680621852E+03 1.00000000E-37 200 -1.758777414454802E-03 1.00000000E+17 -244 -1.758777414445940E-03 1.00000000E-37 -233 1.758777414445940E-03 1.00000000E-37 -277 1.758777414445940E-03 1.00000000E-37 1100 -6.502584003499045E-03 1.00000000E+17 -1144 -6.502584003249676E-03 1.00000000E-37 -1133 6.502584003249676E-03 1.00000000E-37 -1177 6.502584003249676E-03 1.00000000E-37 2000 1.207551512617715E-03 1.00000000E+17 -2044 1.207551509773679E-03 1.00000000E-37 -2033 -1.207551509773679E-03 1.00000000E-37 -2077 -1.207551509773679E-03 1.00000000E-37 40100 -3.849759128833073E-04 1.00000000E+17 -40144 -3.849759126214720E-04 1.00000000E-37 -40133 3.849759126214720E-04 1.00000000E-37 -40177 3.849759126214720E-04 1.00000000E-37 41000 -6.134600794624009E-03 1.00000000E+17 -41044 -6.134600794102827E-03 1.00000000E-37 -41033 6.134600794102827E-03 1.00000000E-37 -41077 6.134600794102827E-03 1.00000000E-37 300 -1.214718666915301E-10 1.00000000E+35 -344 -1.214689176135830E-10 1.00000000E-37 -333 1.214689176135830E-10 1.00000000E-37 -377 1.214689176135830E-10 1.00000000E-37 1200 9.173553200904624E-09 1.00000000E+17 -1244 9.173552005119278E-09 1.00000000E-37 -1233 -9.173552005119278E-09 1.00000000E-37 -1277 -9.173552005119278E-09 1.00000000E-37 2100 2.766286824106416E-08 1.00000000E+17 -2144 2.766284517621553E-08 1.00000000E-37 -2133 -2.766284517621553E-08 1.00000000E-37 -2177 -2.766284517621553E-08 1.00000000E-37 3000 -2.586875110931791E-08 1.00000000E+17 -3044 -2.586871190073453E-08 1.00000000E-37 -3033 2.586871190073453E-08 1.00000000E-37 -3077 2.586871190073453E-08 1.00000000E-37 40200 1.087281236954563E-10 1.00000000E+35 -40244 1.087126769198395E-10 1.00000000E-37 -40233 -1.087126769198395E-10 1.00000000E-37 -40277 -1.087126769198395E-10 1.00000000E-37 41100 3.665038880113199E-09 1.00000000E+35 -41144 3.665037973526605E-09 1.00000000E-37 -41133 -3.665037973526605E-09 1.00000000E-37 -41177 -3.665037973526605E-09 1.00000000E-37 42000 1.599995669220947E-07 1.00000000E+17 -42044 1.599995460520235E-07 1.00000000E-37 -42033 -1.599995460520235E-07 1.00000000E-37 -42077 -1.599995460520235E-07 1.00000000E-37 10011 9.449811827686528E+03 1.00000000E+17 -10055 9.449811827686526E+03 1.00000000E-37 20011 3.469592848592252E+03 1.00000000E+17 -20055 3.469592848592252E+03 1.00000000E-37 30011 2.715959592358086E+03 1.00000000E+17 -30055 2.715959592358085E+03 1.00000000E-37 211 -1.661859079917270E-03 1.00000000E+17 -255 -1.661859079614738E-03 1.00000000E-37 -233 -1.661859079614738E-03 1.00000000E-37 -277 -1.661859079614738E-03 1.00000000E-37 1111 -6.226002255044018E-03 1.00000000E+17 -1155 -6.226002250661060E-03 1.00000000E-37 -1133 -6.226002250661060E-03 1.00000000E-37 -1177 -6.226002250661060E-03 1.00000000E-37 2011 8.546973215184668E-04 1.00000000E+17 -2055 8.546973035456789E-04 1.00000000E-37 -2033 8.546973035456789E-04 1.00000000E-37 -2077 8.546973035456789E-04 1.00000000E-37 40111 -3.549693882720935E-04 1.00000000E+17 -40155 -3.549693875438024E-04 1.00000000E-37 -40133 -3.549693875438024E-04 1.00000000E-37 -40177 -3.549693875438024E-04 1.00000000E-37 41011 -5.887416977150956E-03 1.00000000E+17 -41055 -5.887416974498174E-03 1.00000000E-37 -41033 -5.887416974498174E-03 1.00000000E-37 -41077 -5.887416974498174E-03 1.00000000E-37 311 -1.678870299892799E-10 1.00000000E+35 -355 -1.678505587785410E-10 1.00000000E-37 -333 -1.678505587785410E-10 1.00000000E-37 -377 -1.678505587785410E-10 1.00000000E-37 1211 9.825421614390162E-09 1.00000000E+17 -1255 9.825389349222526E-09 1.00000000E-37 -1233 9.825389349222526E-09 1.00000000E-37 -1277 9.825389349222526E-09 1.00000000E-37 2111 2.175620255282657E-08 1.00000000E+17 -2155 2.175618908490568E-08 1.00000000E-37 -2133 2.175618908490568E-08 1.00000000E-37 -2177 2.175618908490568E-08 1.00000000E-37 3011 -2.679673129520655E-08 1.00000000E+17 -3055 -2.679653715555989E-08 1.00000000E-37 -3033 -2.679653715555989E-08 1.00000000E-37 -3077 -2.679653715555989E-08 1.00000000E-37 40211 8.014519635836165E-11 1.00000000E+35 -40255 8.009364378278709E-11 1.00000000E-37 -40233 8.009364378278709E-11 1.00000000E-37 -40277 8.009364378278709E-11 1.00000000E-37 41111 3.688042790971000E-09 1.00000000E+35 -41155 3.688040663575939E-09 1.00000000E-37 -41133 3.688040663575939E-09 1.00000000E-37 -41177 3.688040663575939E-09 1.00000000E-37 42011 1.723828262812536E-07 1.00000000E+17 -42055 1.723828185135588E-07 1.00000000E-37 -42033 1.723828185135588E-07 1.00000000E-37 -42077 1.723828185135588E-07 1.00000000E-37 10022 9.414679701482310E+03 1.00000000E+17 -10066 9.414679701482288E+03 1.00000000E-37 20022 3.565085085629393E+03 1.00000000E+17 -20066 3.565085085629392E+03 1.00000000E-37 30022 2.777265180812084E+03 1.00000000E+17 -30066 2.777265180812084E+03 1.00000000E-37 222 -1.733689000222170E-03 1.00000000E+17 -266 -1.733688999705680E-03 1.00000000E-37 -233 -1.733688999705680E-03 1.00000000E-37 -277 -1.733688999705680E-03 1.00000000E-37 1122 -6.452613433218239E-03 1.00000000E+17 -1166 -6.452613413760720E-03 1.00000000E-37 -1133 -6.452613413760720E-03 1.00000000E-37 -1177 -6.452613413760720E-03 1.00000000E-37 2022 1.225851934971103E-03 1.00000000E+17 -2066 1.225851810215672E-03 1.00000000E-37 -2033 1.225851810215672E-03 1.00000000E-37 -2077 1.225851810215672E-03 1.00000000E-37 40122 -3.756057435583900E-04 1.00000000E+17 -40166 -3.756057424419471E-04 1.00000000E-37 -40133 -3.756057424419471E-04 1.00000000E-37 -40177 -3.756057424419471E-04 1.00000000E-37 41022 -6.035934790743991E-03 1.00000000E+17 -41066 -6.035934788022055E-03 1.00000000E-37 -41033 -6.035934788022055E-03 1.00000000E-37 -41077 -6.035934788022055E-03 1.00000000E-37 322 -1.351065230251358E-10 1.00000000E+35 -366 -1.349356744061989E-10 1.00000000E-37 -333 -1.349356744061989E-10 1.00000000E-37 -377 -1.349356744061989E-10 1.00000000E-37 1222 1.111509572606106E-08 1.00000000E+17 -1266 1.111500630253112E-08 1.00000000E-37 -1233 1.111500630253112E-08 1.00000000E-37 -1277 1.111500630253112E-08 1.00000000E-37 2122 2.343735401487774E-08 1.00000000E+17 -2166 2.343686331629235E-08 1.00000000E-37 -2133 2.343686331629235E-08 1.00000000E-37 -2177 2.343686331629235E-08 1.00000000E-37 3022 -1.830187614216253E-08 1.00000000E+17 -3066 -1.830040405264028E-08 1.00000000E-37 -3033 -1.830040405264028E-08 1.00000000E-37 -3077 -1.830040405264028E-08 1.00000000E-37 40222 1.116930404243763E-10 1.00000000E+35 -40266 1.116093797997412E-10 1.00000000E-37 -40233 1.116093797997412E-10 1.00000000E-37 -40277 1.116093797997412E-10 1.00000000E-37 41122 3.397087505405343E-09 1.00000000E+35 -41166 3.397085734332218E-09 1.00000000E-37 -41133 3.397085734332218E-09 1.00000000E-37 -41177 3.397085734332218E-09 1.00000000E-37 42022 1.708461523300118E-07 1.00000000E+17 -42066 1.708461211903259E-07 1.00000000E-37 -42033 1.708461211903259E-07 1.00000000E-37 -42077 1.708461211903259E-07 1.00000000E-37 10033 9.413510043347715E+03 1.00000000E+17 -10077 9.413510043347707E+03 1.00000000E-37 20033 3.446365440175177E+03 1.00000000E+17 -20077 3.446365440175170E+03 1.00000000E-37 30033 2.704763066700662E+03 1.00000000E+17 -30077 2.704763066700657E+03 1.00000000E-37 110010000 -1.001365716636277E+02 1.00000000E+02 -110010022 -1.001365716613905E+02 1.00000000E-37 -110010011 -7.891745851261230E+01 1.00000000E-37 -110010033 -7.891745851261230E+01 1.00000000E-37 110040000 2.139752706212140E+00 1.00000000E+02 -110040022 2.139752694862028E+00 1.00000000E-37 -110040011 1.686335387986972E+00 1.00000000E-37 -110040033 1.686335387986972E+00 1.00000000E-37 220010000 -2.897241166332818E+01 1.00000000E+02 -220010011 -2.897241042701371E+01 1.00000000E-37 -220010022 -2.283310642279190E+01 1.00000000E-37 -220010033 -2.283310642279190E+01 1.00000000E-37 220040000 -1.799148501176755E+01 1.00000000E+02 -220040033 1.417905761646577E+01 1.00000000E-37 220040011 -1.799137017577003E+01 1.00000000E+02 -220040033 -1.417896424652372E+01 1.00000000E-37 220040022 -1.419849932212700E+01 1.00000000E+02 -220040033 -1.419849877527321E+01 1.00000000E-37