Thiomethyl / ms-TPES 8.25-12.5 eV<BR>E I<BR>8.2522 0.01618<BR>8.256 0.00205<BR>8.2595 -0.01186<BR>8.2634 0.00222<BR>8.271 0.01289<BR>8.2753 0.01496<BR>8.2811 -0.00976<BR>8.2866 -0.03003<BR>8.2887 0.01561<BR>8.2952 -0.00117<BR>8.301 -0.00654<BR>8.3062 0.00559<BR>8.3097 0.0145<BR>8.3169 0.02077<BR>8.3227 0.00615<BR>8.3254 0.02315<BR>8.3319 -0.01718<BR>8.3361 -0.01148<BR>8.3395 0.000880691<BR>8.3466 -0.00393<BR>8.3496 -0.00177<BR>8.3567 0.0062<BR>8.36 -0.01552<BR>8.3656 -0.01093<BR>8.3707 -0.01557<BR>8.3742 -0.00327<BR>8.3805 0.00609<BR>8.3865 -0.00888<BR>8.3893 -0.000670212<BR>8.395 0.000786529<BR>8.4006 0.00139<BR>8.4045 0.01352<BR>8.4113 0.03018<BR>8.4153 0.00852<BR>8.4201 0.01141<BR>8.4254 0.00532<BR>8.4298 -0.0164<BR>8.4353 0.00276<BR>8.4391 -0.01247<BR>8.4451 -0.000614822<BR>8.4514 0.00953<BR>8.4546 -0.000343414<BR>8.4603 -0.01126<BR>8.4638 0.00753<BR>8.4695 -0.01356<BR>8.4742 -0.01596<BR>8.478 0.02876<BR>8.4853 -0.00837<BR>8.4897 0.01062<BR>8.4982 -0.00604<BR>8.502 0.00543<BR>8.5045 0.00854<BR>8.5103 0.0191<BR>8.5146 -0.00975<BR>8.5201 -0.00561<BR>8.5274 -0.01009<BR>8.5327 -0.00217<BR>8.5357 -0.00188<BR>8.5401 0.0104<BR>8.5449 -0.02925<BR>8.5512 -0.02537<BR>8.554 -0.00128<BR>8.5613 -0.02077<BR>8.5656 -0.01002<BR>8.5684 0.00444<BR>8.5758 0.01291<BR>8.5803 0.03522<BR>8.5855 0.01697<BR>8.5915 0.01296<BR>8.5961 0.00814<BR>8.5992 -0.01146<BR>8.6051 0.01097<BR>8.6103 -0.00121<BR>8.6164 -0.01916<BR>8.6212 -0.0298<BR>8.625 -0.02653<BR>8.6316 0.00621<BR>8.637 -0.02177<BR>8.6399 -0.00757<BR>8.6466 0.00627<BR>8.6506 -0.0123<BR>8.656 -0.0077<BR>8.6633 0.00641<BR>8.6629 0.00724<BR>8.6692 -0.000947159<BR>8.6752 0.02404<BR>8.6785 0.00376<BR>8.6842 0.00859<BR>8.6913 0.01479<BR>8.6957 0.0035<BR>8.6997 -0.01479<BR>8.7044 0.00315<BR>8.7094 0.00644<BR>8.7158 -0.0078<BR>8.7202 0.00781<BR>8.7244 -0.00755<BR>8.7312 -0.01916<BR>8.7351 -0.00737<BR>8.7419 -0.0066<BR>8.7453 -0.003<BR>8.7493 -0.02188<BR>8.7564 0.00627<BR>8.7597 0.000936081<BR>8.7647 -0.00454<BR>8.7692 0.00354<BR>8.7749 -0.01174<BR>8.7799 -0.00638<BR>8.7861 0.02327<BR>8.7906 0.000271408<BR>8.7962 -0.03095<BR>8.8003 -0.004<BR>8.8052 0.00421<BR>8.8097 -0.01923<BR>8.816 0.02622<BR>8.8202 -0.01097<BR>8.826 0.01894<BR>8.8313 0.0102<BR>8.8337 0.00117<BR>8.8384 0.02896<BR>8.8443 0.00216<BR>8.8505 -0.0021<BR>8.8558 0.01694<BR>8.8608 0.02065<BR>8.8636 -0.01307<BR>8.8706 -0.00459<BR>8.8771 0.02696<BR>8.8815 0.02205<BR>8.8849 0.00652<BR>8.8908 0.03567<BR>8.8943 -0.01063<BR>8.9008 -0.00389<BR>8.9067 0.03342<BR>8.9092 0.0103<BR>8.9169 0.03239<BR>8.9201 0.01024<BR>8.9246 0.00842<BR>8.9298 0.03682<BR>8.9359 0.02574<BR>8.9402 0.02552<BR>8.9456 0.01733<BR>8.9506 -0.0271<BR>8.9553 0.02161<BR>8.9584 0.01419<BR>8.964 -0.01678<BR>8.9706 -0.00737<BR>8.9786 0.000332336<BR>8.9797 0.01929<BR>8.9829 -0.00299<BR>8.9897 0.02746<BR>8.9969 -0.00321<BR>9.0006 0.00991<BR>9.005 0.00914<BR>9.0089 -0.00316<BR>9.014 0.00587<BR>9.0212 0.00121<BR>9.023 0.04143<BR>9.0297 -0.01363<BR>9.0348 0.03943<BR>9.0402 0.01335<BR>9.0453 0.02137<BR>9.0506 0.0385<BR>9.0542 0.01678<BR>9.0595 -0.01976<BR>9.0623 0.01063<BR>9.0687 -0.00139<BR>9.0734 0.01129<BR>9.0792 0.01918<BR>9.0858 -0.00652<BR>9.0894 0.0206<BR>9.0954 0.01662<BR>9.1 0.03174<BR>9.106 0.0128<BR>9.1092 0.01923<BR>9.1138 0.0514<BR>9.1206 0.01129<BR>9.1261 -0.02355<BR>9.1285 0.06053<BR>9.1359 0.03695<BR>9.14 -0.00931<BR>9.1428 0.03125<BR>9.1497 0.03995<BR>9.1574 0.07484<BR>9.1604 0.00492<BR>9.1655 0.01779<BR>9.1734 0.04614<BR>9.175 0.06507<BR>9.1787 -0.01784<BR>9.185 0.03152<BR>9.1895 0.06036<BR>9.1944 0.06419<BR>9.2007 0.10003<BR>9.2032 0.16329<BR>9.2071 0.19286<BR>9.2142 0.36895<BR>9.2194 0.3308<BR>9.2231 0.31689<BR>9.2298 0.37748<BR>9.2331 0.52092<BR>9.2387 0.71396<BR>9.2482 0.77961<BR>9.2523 0.90978<BR>9.255 0.74847<BR>9.2614 0.55845<BR>9.2643 0.3915<BR>9.2689 0.17148<BR>9.276 -0.0251<BR>9.2795 0.06297<BR>9.2837 0.01624<BR>9.291 0.10923<BR>9.2947 0.10546<BR>9.3001 0.10756<BR>9.306 0.14734<BR>9.3096 0.20975<BR>9.3148 0.28377<BR>9.3213 0.18712<BR>9.3251 0.30172<BR>9.3297 0.42445<BR>9.3354 0.48218<BR>9.3411 0.56186<BR>9.3466 0.51568<BR>9.3495 0.4182<BR>9.3561 0.30264<BR>9.3597 0.33953<BR>9.3643 0.32404<BR>9.3692 0.21775<BR>9.3768 0.18971<BR>9.3805 0.23867<BR>9.3836 0.21946<BR>9.3902 0.04199<BR>9.3928 0.05895<BR>9.3998 0.11976<BR>9.4056 0.07899<BR>9.4097 0.1125<BR>9.4154 0.08153<BR>9.4197 0.1068<BR>9.4253 0.13072<BR>9.4307 0.10518<BR>9.4348 0.03987<BR>9.4384 0.11599<BR>9.4466 0.08401<BR>9.4503 0.15182<BR>9.4555 0.03722<BR>9.4587 0.01583<BR>9.4663 0.06657<BR>9.4712 0.07482<BR>9.4752 0.02382<BR>9.4797 0.03661<BR>9.4858 0.06169<BR>9.4886 0.04159<BR>9.4962 0.07488<BR>9.5026 0.09489<BR>9.5039 0.01528<BR>9.5089 0.0986<BR>9.5161 0.07599<BR>9.5192 0.02032<BR>9.5242 0.0138<BR>9.5303 0.06718<BR>9.5361 0.06276<BR>9.5402 0.09202<BR>9.5455 0.02908<BR>9.5515 0.03677<BR>9.5545 0.06308<BR>9.5609 0.01616<BR>9.5656 -0.01635<BR>9.5707 0.06564<BR>9.5749 0.0926<BR>9.5822 0.08264<BR>9.5873 0.08512<BR>9.5895 0.11234<BR>9.5975 0.13344<BR>9.6011 0.03999<BR>9.6031 0.09478<BR>9.612 0.09444<BR>9.6154 0.02674<BR>9.6194 0.08329<BR>9.6254 0.05429<BR>9.6319 0.06016<BR>9.636 0.08869<BR>9.6389 0.08545<BR>9.6465 -0.01529<BR>9.6508 0.00998<BR>9.6533 0.02736<BR>9.6589 -0.00426<BR>9.6668 -0.01883<BR>9.6709 0.11271<BR>9.6749 0.13399<BR>9.6804 0.0497<BR>9.6869 -0.00438<BR>9.6894 0.04719<BR>9.6946 0.000509582<BR>9.7015 0.1111<BR>9.7056 0.09653<BR>9.7085 0.09772<BR>9.7167 0.03013<BR>9.7238 0.0515<BR>9.7261 0.02907<BR>9.7313 0.04853<BR>9.7357 0.02054<BR>9.7405 0.06613<BR>9.7453 0.09827<BR>9.7488 0.04377<BR>9.7573 0.08862<BR>9.76 0.10695<BR>9.7658 0.03978<BR>9.7706 0.07792<BR>9.7759 0.04065<BR>9.7785 0.07056<BR>9.7856 0.04259<BR>9.7912 0.1296<BR>9.7951 0.06807<BR>9.8002 0.08635<BR>9.8023 0.0745<BR>9.8086 0.10032<BR>9.8146 0.00705<BR>9.8179 0.00537<BR>9.8272 0.01906<BR>9.831 0.03672<BR>9.8342 -0.01494<BR>9.8394 0.14694<BR>9.8443 0.12212<BR>9.8508 0.08591<BR>9.8534 0.08508<BR>9.8612 0.15238<BR>9.8663 0.1089<BR>9.8685 0.01956<BR>9.8748 0.06663<BR>9.8788 0.10558<BR>9.8819 0.0673<BR>9.8916 -0.01591<BR>9.8961 0.10302<BR>9.8987 0.1315<BR>9.9053 0.01246<BR>9.911 0.11222<BR>9.9243 0.15941<BR>9.9167 0.07726<BR>9.9248 0.11394<BR>9.9284 0.15287<BR>9.9353 0.0822<BR>9.9388 0.13726<BR>9.9419 0.04718<BR>9.9508 0.20709<BR>9.9553 0.13914<BR>9.9608 0.112<BR>9.9661 0.15548<BR>9.9704 0.14356<BR>9.9738 0.05606<BR>9.9779 0.09754<BR>9.988 0.14457<BR>9.9911 0.09938<BR>9.994 0.10679<BR>9.9989 0.0488<BR>10.0051 -0.000736679<BR>10.0107 0.14441<BR>10.0148 0.16268<BR>10.0214 0.17881<BR>10.026 0.18987<BR>10.0309 0.09295<BR>10.036 0.16399<BR>10.0411 0.11322<BR>10.0435 0.10845<BR>10.0491 0.19475<BR>10.0564 0.17808<BR>10.0618 0.04631<BR>10.0608 0.18788<BR>10.0679 0.15264<BR>10.0721 0.14374<BR>10.0775 0.14695<BR>10.0846 0.00841<BR>10.0881 0.20289<BR>10.0945 0.1856<BR>10.0996 0.1208<BR>10.1038 0.14484<BR>10.1112 0.20351<BR>10.1159 0.16783<BR>10.1201 0.25779<BR>10.1256 0.17847<BR>10.1305 0.11277<BR>10.138 0.16068<BR>10.1427 0.25518<BR>10.1442 0.14778<BR>10.1497 0.13875<BR>10.1561 0.20133<BR>10.1611 0.23723<BR>10.1659 0.2031<BR>10.1706 0.09007<BR>10.1749 0.18328<BR>10.1789 0.36014<BR>10.1876 0.33754<BR>10.1904 0.30846<BR>10.1952 0.2919<BR>10.1994 0.23497<BR>10.204 0.22283<BR>10.2092 0.28354<BR>10.2153 0.48017<BR>10.2198 0.49569<BR>10.2236 0.45535<BR>10.2297 0.40778<BR>10.2332 0.41831<BR>10.2406 0.50654<BR>10.2439 0.39149<BR>10.251 0.31058<BR>10.2563 0.25729<BR>10.2594 0.39055<BR>10.2662 0.19587<BR>10.2703 0.37161<BR>10.2754 0.22492<BR>10.2795 0.19247<BR>10.2828 0.281<BR>10.2884 0.37991<BR>10.2966 0.24128<BR>10.3002 0.30732<BR>10.3066 0.42788<BR>10.3102 0.35977<BR>10.3148 0.48305<BR>10.3187 0.51551<BR>10.3259 0.50991<BR>10.3311 0.49236<BR>10.3339 0.54535<BR>10.3398 0.39253<BR>10.3471 0.36546<BR>10.3502 0.15831<BR>10.3554 0.23003<BR>10.3585 0.24145<BR>10.3673 0.19325<BR>10.372 0.20382<BR>10.3748 0.2591<BR>10.3811 0.23614<BR>10.3868 0.13791<BR>10.3912 0.15881<BR>10.3933 0.13746<BR>10.3998 0.27827<BR>10.4074 0.17874<BR>10.4119 0.13555<BR>10.4137 0.24001<BR>10.4211 0.27735<BR>10.4234 0.25057<BR>10.4297 0.18102<BR>10.4342 0.25163<BR>10.4392 0.19347<BR>10.4455 0.20666<BR>10.4511 0.14259<BR>10.4545 0.08994<BR>10.4603 0.11294<BR>10.4648 0.14446<BR>10.4706 0.10913<BR>10.4727 0.14308<BR>10.4772 0.02914<BR>10.4876 0.10833<BR>10.49 0.1245<BR>10.494 0.10408<BR>10.4993 0.05351<BR>10.5068 0.03671<BR>10.5084 0.14737<BR>10.5126 0.0492<BR>10.5199 0.09023<BR>10.5281 0.10005<BR>10.5265 0.16366<BR>10.5319 0.07328<BR>10.5402 0.05881<BR>10.545 0.01878<BR>10.5502 0.10799<BR>10.5528 0.21203<BR>10.5612 0.11414<BR>10.5663 0.38237<BR>10.5709 0.05847<BR>10.575 0.17946<BR>10.5817 0.23995<BR>10.5844 0.24927<BR>10.5915 -0.0058<BR>10.5961 0.09571<BR>10.5985 0.15538<BR>10.6026 0.1602<BR>10.608 0.1233<BR>10.6113 0.15121<BR>10.62 0.03573<BR>10.6268 0.18495<BR>10.6293 0.22915<BR>10.635 0.2491<BR>10.6399 0.17946<BR>10.6473 0.21186<BR>10.6498 0.31058<BR>10.6547 0.38735<BR>10.6591 0.36356<BR>10.666 0.17815<BR>10.6682 0.06167<BR>10.6734 0.1165<BR>10.6806 0.21467<BR>10.6844 0.07164<BR>10.693 0.01977<BR>10.6963 0.28184<BR>10.6988 0.36125<BR>10.7032 0.17596<BR>10.7099 0.14704<BR>10.7154 0.09287<BR>10.7196 0.33598<BR>10.7265 0.09254<BR>10.7293 0.10317<BR>10.7318 0.05847<BR>10.741 0.14754<BR>10.7438 0.04521<BR>10.7505 0.10153<BR>10.7552 0.08207<BR>10.7586 0.11848<BR>10.7645 0.12396<BR>10.7729 0.20189<BR>10.7754 0.05184<BR>10.7779 0.13278<BR>10.7838 0.05749<BR>10.788 0.22283<BR>10.7953 0.24011<BR>10.7993 0.09719<BR>10.808 0.12944<BR>10.8103 0.20025<BR>10.8151 0.17315<BR>10.8199 0.14704<BR>10.827 0.13245<BR>10.8312 0.24045<BR>10.8358 0.117<BR>10.8414 0.24493<BR>10.8431 0.06348<BR>10.8531 0.18543<BR>10.8545 0.03654<BR>10.8611 0.13362<BR>10.8639 0.23096<BR>10.8688 0.26338<BR>10.8759 0.2672<BR>10.8802 0.24412<BR>10.8839 0.28548<BR>10.8908 0.22301<BR>10.8959 0.38154<BR>10.8982 0.24658<BR>10.9069 0.23961<BR>10.9094 0.31986<BR>10.9169 0.14837<BR>10.9218 0.19093<BR>10.9221 0.29478<BR>10.9256 0.10136<BR>10.9386 0.25592<BR>10.9394 0.10553<BR>10.9461 0.39317<BR>10.9499 0.31042<BR>10.9548 0.29709<BR>10.9623 0.13295<BR>10.9641 0.30224<BR>10.971 0.17846<BR>10.9719 0.17031<BR>10.9812 0.08672<BR>10.9865 0.13142<BR>10.9885 0.29909<BR>10.9944 0.29063<BR>10.9996 0.25904<BR>11.0069 0.08858<BR>11.0072 0.2167<BR>11.0181 0.26886<BR>11.0239 0.28612<BR>11.0266 0.0269<BR>11.0339 0.45366<BR>11.038 0.18775<BR>11.0386 0.389<BR>11.0445 0.33149<BR>11.0516 0.04621<BR>11.0581 0.18829<BR>11.0581 0.26771<BR>11.0634 0.46991<BR>11.0705 0.38001<BR>11.0776 0.36093<BR>11.0794 0.16883<BR>11.0836 0.31088<BR>11.0931 0.4116<BR>11.0972 0.23298<BR>11.0972 0.35013<BR>11.1071 0.1725<BR>11.1103 0.40926<BR>11.113 0.16236<BR>11.1208 0.39114<BR>11.1235 0.39467<BR>11.1328 0.41726<BR>11.1346 0.61929<BR>11.1385 0.29909<BR>11.146 0.25143<BR>11.149 0.3395<BR>11.1523 0.26437<BR>11.1568 0.60701<BR>11.164 0.31805<BR>11.1727 0.51344<BR>11.1751 0.30758<BR>11.1797 0.2619<BR>11.183 0.36642<BR>11.1912 0.12562<BR>11.1942 0.21019<BR>11.2024 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