Version2.4 2021-06-07T16:53:15Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 26-Jun-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CN(CCc1ccc(c(c1)OC)OC)C(=O)CCc2c(nc(nn2)c3cccc(c3)OCCC=C)[O-] C35922545 RHF 6-31G(d) (6D,7F) CN(CCc1ccc(c(c1)OC)OC)C(=O)CCc2c(nc(nn2)c3cccc(c3)OCCC=C)[O-] C01[X(C27H31N4O5)] 195 C1 602 C=CCCOc1cccc(c1)c1nnc(c(n1)[O-])CCC(=O)N(CCc1ccc(c(c1)OC)OC)C C=CCCOc1cccc(c1)c1nnc(c(n1)[O-])CCC(=O)N(CCc1ccc(c(c1)OC)OC)C COc1ccc(CCN(C)C(=O)CCc2nnc(nc2[O-])c3cccc(OCCC=C)c3)cc1OC InChIKey=HCSSYJBFHNQAPR-UHFFFAOYSA-M InChI=1S/C27H32N4O5/c1-5-6-16-36-21-9-7-8-20(18-21)26-28-27(33)22(29-30-26)11-13-25(32)31(2)15-14-19-10-12-23(34-3)24(17-19)35-4/h5,7-10,12,17-18H,1,6,11,13-16H2,2-4H3,(H,28,30,33)/p-1 InChI=1/C27H32N4O5/c1-5-6-16-36-21-9-7-8-20(18-21)26-28-27(33)22(29-30-26)11-13-25(32)31(2)15-14-19-10-12-23(34-3)24(17-19)35-4/h5,7-10,12,17-18H,1,6,11,13-16H2,2-4H3,(H,28,30,33)/p-1/fC27H31N4O5/q-1 CN(CCc1ccc(c(c1)OC)OC)C(=O)CCc2c(nc(nn2)c3cccc(c3)OCCC=C)[O-] C01[X(C27H31N4O5)] 195 C01 602 C=CCCOc1cccc(c1)c1nnc(c(n1)[O-])CCC(=O)N(CCc1ccc(c(c1)OC)OC)C C=CCCO[C]1[CH][CH][CH][C]([CH]1)[C]1[N][N]=C([C]([N]1)=O)CCC(=O)N(CC[C]1[CH][CH][C]([C]([CH]1)OC)OC)C CO[C]1[CH][CH][C]([CH][C]1OC)CCN(C)C(=O)CCC2=N[N][C]([N]C2=O)[C]3[CH][CH][CH][C]([CH]3)OCCC=C InChIKey=LOULFELRIUNTIM-UHFFFAOYSA-N InChI=1S/C27H31N4O5/c1-5-6-16-36-21-9-7-8-20(18-21)26-28-27(33)22(29-30-26)11-13-25(32)31(2)15-14-19-10-12-23(34-3)24(17-19)35-4/h5,7-10,12,17-18H,1,6,11,13-16H2,2-4H3 InChI=1/C27H31N4O5/c1-5-6-16-36-21-9-7-8-20(18-21)26-28-27(33)22(29-30-26)11-13-25(32)31(2)15-14-19-10-12-23(34-3)24(17-19)35-4/h5,7-10,12,17-18H,1,6,11,13-16H2,2-4H3 3335.1793625041 -1632.5804359 1-A 50230.8046 131 471 602 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1.0015 0.6674 1.3764 1.1737 1.2123 1.4496 1.6209 1.2347 0.5085 0.8770 2.7474 1.6023 1.3012 1.4170 1.3332 1.7914 0.7858 0.7432 0.6214 1.0706 1.0382 0.8986 1.8177 2.7667 0.8766 0.8320 1.1713 2.2120 0.8735 0.9535 0.8943 2.2639 4.1653 1.1469 1.8687 0.9502 2.7215 1.7217 2.0460 1.0419 1.7215 1.8469 3.1203 2.2231 4.1111 2.5387 2.0029 1.9701 5.3304 1.6227 1.2517 2.3606 1.7404 1.7333 1.7979 1.2512 1.2554 1.7881 2.0224 1.6664 1.8726 1.5977 1.8925 1.3603 3.7907 3.0207 2.3679 2.0249 1.5178 1.8843 1.7104 1.3842 1.4935 1.9228 1.6278 2.3873 3.9068 4.0760 2.5479 2.0771 6.1664 2.0900 3.0757 3.7095 1.9729 1.9030 3.0046 2.1013 1.7897 1.8860 1.7497 1.9580 1.8909 1.7652 4.3900 1.6836 1.6831 1.7297 1.7202 1.7202 1.8961 2.2703 5.1871 5.0859 12.3138 11.7933 16.6011 11.6441 11.3616 23.4030 8.9235 23.1487 6.3146 6.4383 6.2993 6.2298 6.2738 6.4966 6.5167 6.7064 6.5777 6.5759 6.8978 6.8462 6.9298 6.9857 6.9233 6.9735 7.0697 6.9544 7.1231 7.1136 7.1627 7.0189 7.2138 7.1792 7.2338 7.3925 7.4141 7.4315 7.6039 7.5628 7.5731 1.3090 1.2138 0.4819 0.6074 2.7279 0.9706 0.7825 0.8815 6.4824 2.6972 1.1982 2.8708 2.6018 1.5723 1.0271 0.4796 1.4976 2.8260 0.4266 7.1584 3.9673 1.8050 3.8234 4.3421 4.1236 0.3561 1.4261 0.3514 1.9019 0.8149 1.8547 1.1747 0.5483 4.2878 5.4405 3.4603 1.1538 1.5299 2.5245 5.2264 13.2734 8.5350 0.3845 3.9772 11.3872 0.7911 0.7454 2.5876 14.7778 10.7088 37.3941 2.9596 9.8099 22.9510 2.3446 6.5938 4.9932 3.4184 12.1263 2.3361 15.8705 6.7709 8.3099 0.1891 0.2554 22.8612 23.3978 26.7115 0.6503 36.3966 3.4943 34.1242 2.5634 38.4074 19.2271 40.7534 14.9352 0.1612 11.6888 11.2814 5.9704 20.9501 49.6323 12.7527 3.7269 4.8926 3.9240 0.9779 10.0721 3.0361 3.3756 11.8211 29.1078 29.9578 32.3683 13.5586 2.0255 1.8353 96.1454 132.2025 67.9788 56.8016 12.6871 9.3113 52.0338 89.0208 3.4628 3.0306 3.3344 195.3938 55.0841 11.7556 26.2889 13.6710 42.2528 3.7843 307.8142 119.6946 91.8789 24.4783 3.6653 107.8510 13.5543 5.1029 0.4937 54.4783 4.2565 53.5064 185.7703 345.9949 39.1480 71.7172 101.0036 207.3069 63.6698 141.0422 66.8572 54.1958 211.7181 72.8566 21.1137 30.8280 7.6740 11.3022 24.2538 4.7189 67.9408 2.1392 5.7069 6.3375 25.1916 30.3634 79.3418 46.5401 143.2960 263.3091 61.6007 31.3534 38.2968 79.7491 19.9221 793.9508 8.4850 286.5143 36.9819 19.5273 47.2340 73.6051 42.3405 39.0997 15.6709 49.6754 46.4974 30.1134 65.4461 51.3257 31.9704 40.7360 30.9388 12.5951 17.1504 37.6377 53.9276 17.9584 57.2689 12.5797 25.5055 37.4685 20.1934 39.4482 17.9338 11.3396 33.1218 3.1224 1.9181 1.5260 0.3943 1.9159 3.5080 1.5451 1.5869 1.2563 1.5994 1.0095 3.2923 0.6914 3.0489 1.8042 1.9528 1.6750 0.7775 2.8463 0.9717 0.5585 0.5512 0.9087 1.0549 0.9073 0.9344 1.1518 1.1390 3.1900 0.4161 1.7280 2.9843 1.9027 0.9241 1.0596 1.1367 1.0955 2.3994 1.2147 0.4325 3.0074 3.7781 0.3162 2.8203 0.2116 1.4562 0.4775 1.6063 1.7418 0.6436 0.6596 4.0736 4.5653 5.1789 0.4107 0.4342 2.4499 1.3517 1.4776 1.5313 2.3054 0.5649 8.4196 0.3441 12.8732 6.7700 1.9001 0.7545 5.3448 21.7042 1.2291 2.6793 0.5388 4.7474 5.1813 1.7912 1.3008 11.8953 2.1705 1.9965 8.8618 4.9626 2.0301 2.3932 2.1497 9.5515 54.8121 0.9388 3.8796 0.4617 21.2002 1.8491 4.5987 1.8674 12.9509 13.6926 6.1240 12.3178 7.2117 3.9386 15.8008 8.4987 30.7633 4.4061 5.5094 35.1413 2.4703 1.5412 4.3493 3.9453 4.5087 5.9934 63.0909 6.2828 3.6995 7.6865 0.2104 2.6429 1.5305 8.7659 10.0833 2.7896 23.5962 11.9943 6.7998 24.8164 30.0083 2.1534 9.0126 8.5246 47.3332 115.7708 7.5643 23.6019 22.2960 2.0883 4.6566 3.5490 17.2497 62.1761 54.3488 5.8314 9.1129 10.0164 11.7139 5.7848 3.8061 6.9603 0.7424 27.0332 19.7717 17.0523 13.5736 11.6811 25.2374 55.5760 169.3621 11.2755 132.5509 12.0799 4.9374 181.2228 87.5749 17.6214 48.4920 3.3534 63.2185 48.5165 64.6568 123.9318 103.3296 60.3567 105.2458 34.9118 92.6189 76.0659 51.0987 86.2051 34.5006 27.9439 49.9696 71.4722 5.7259 29.9830 142.0942 20.2546 136.0990 146.7700 74.6732 106.4124 63.4997 138.3598 1.6067 168.1451 92.8909 63.5970 42.7018 0.7500 0.7494 0.7499 0.7500 0.7454 0.7145 0.7499 0.7492 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1 1 1 1 1 1 1 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 14.00307 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 5575.5477 87883.2048 89769.9338 0.99999 -0.00377 -0.00015 0.00376 0.99917 -0.04052 0.00031 0.04052 0.99918 1 0.01553 0.00099 0.00096 0.32369 0.02054 0.02010 11.80 12.07 15.79 26.76 35.64 38.46 56.71 65.10 75.91 90.91 99.49 110.98 113.06 124.79 125.79 148.67 152.70 180.70 196.42 218.19 234.29 240.73 254.51 266.29 295.08 339.83 343.84 353.58 361.86 394.50 404.74 415.00 435.81 445.64 479.63 496.69 520.48 548.59 585.38 596.82 627.39 640.08 670.37 676.78 714.31 747.21 753.48 766.00 773.44 821.70 882.94 893.96 918.87 923.41 936.55 939.44 941.02 962.13 1002.98 1017.79 1030.78 1101.90 1114.73 1138.52 1157.31 1185.53 1203.38 1209.81 1219.62 1255.66 1265.39 1287.64 1296.66 1324.76 1334.74 1375.23 1446.84 1451.54 1473.88 1484.18 1498.10 1504.94 1537.48 1544.76 1560.18 1574.28 1586.61 1599.48 1611.82 1624.45 1636.71 1646.10 1649.64 1679.49 1679.67 1719.29 1724.78 1729.26 1738.39 1761.29 1769.72 1780.97 1798.73 1804.28 1837.90 1846.91 1854.88 1859.98 1863.47 1864.45 1886.94 1901.89 1908.57 1921.52 1937.88 1959.61 2007.62 2020.58 2027.71 2035.33 2050.15 2063.11 2067.77 2070.93 2080.22 2088.35 2093.54 2113.00 2125.33 2137.29 2202.94 2236.26 2242.63 2267.22 2276.09 2279.66 2298.23 2322.47 2329.58 2335.13 2344.52 2347.57 2353.53 2355.93 2360.07 2371.76 2372.54 2375.24 2376.17 2384.19 2390.07 2392.39 2401.35 2417.59 2427.91 2454.16 2553.26 2577.36 2586.95 2610.72 2618.08 2647.73 2702.56 2748.86 4579.09 4594.12 4597.21 4598.08 4618.22 4620.93 4621.25 4636.31 4641.57 4660.08 4679.60 4683.76 4698.41 4709.60 4710.14 4730.70 4754.82 4761.41 4768.70 4771.88 4777.10 4788.36 4808.76 4811.63 4827.61 4875.25 4885.43 4888.42 4891.67 4929.68 4935.90 0.589158 0.622842 0.623786 0.514809 -1631.991278 -1631.957594 -1631.956650 -1632.065627 3.655106D-04 MUNgauss RevisionA2.1 retrievium 07-Jun-2021 DUDE CN(CCc1ccc(c(c1)OC)OC)C(=O)CCc2c(nc(nn2)c3cccc(c3)OCCC=C)[O-] C35922545 RHF 6-31G(d) (6D,10F) C1 491.229445 |X|Y|Z| 216.223280 47.445209 35.031154 71.096750 24 6 7 20 4 |36.858105| |13.158366|53.358707| |7.684438|17.864327|36.858105| |5.577090|10.428725|12.406263|36.858105| |4.012603|6.788540|7.526200|12.597438|36.858105| |3.513444|5.427006|5.472378|7.525972|13.870265|36.858105| |2.825970|4.290557|4.080236|4.993158|7.904161|13.623772|36.858105| |2.575725|3.999163|3.749947|4.414487|6.794449|7.905336|13.862795|36.858105| |2.757393|4.472266|4.265819|5.022848|7.857936|6.867482|7.938585|13.515024|36.858105| |3.373230|5.780631|5.910244|7.576917|13.577305|7.990838|6.913667|7.917925|13.853768|36.858105| |2.399194|3.855153|3.485072|3.867027|5.169190|4.624196|5.299040|8.156946|14.133614|7.897429|73.516695| |2.401792|3.932886|3.452179|3.703320|4.516487|3.809093|3.996340|5.246292|8.041021|6.767099|24.215415|36.858105| |2.186801|3.327075|2.986854|3.363322|4.586284|5.176817|7.875376|14.085339|8.137516|5.284746|13.098771|4.783774|73.516695| |2.013729|2.982531|2.621242|2.919242|3.785137|4.515885|6.752912|8.046939|5.248038|3.992680|8.515318|3.546063|24.310744|36.858105| |7.646186|18.960482|7.899664|5.896847|4.227299|3.359932|2.775670|2.686396|3.083779|3.932765|4.905658|2.932654|4.049364|2.026043|36.858105| |5.325207|11.621841|7.170266|5.890181|4.485197|3.432493|2.885593|2.883259|3.446691|4.488175|5.570577|3.457661|4.334715|2.125880|15.785042|73.516695| |6.592345|10.516975|5.018046|4.142225|3.194662|2.691807|2.289834|2.216053|2.479071|3.002380|4.040910|2.414076|3.429277|1.747330|12.564812|14.154500|36.858105| |4.329248|6.833409|3.851676|3.354836|2.751579|2.336519|2.046272|2.026061|2.286333|2.704086|3.837145|2.348945|3.189175|1.620969|7.481907|12.064058|12.451503|36.858105| |3.634917|5.218237|3.045915|2.721253|2.289662|2.004437|1.778852|1.753316|1.939469|2.235881|3.277664|1.983240|2.799067|1.442180|4.917481|7.879913|7.592102|12.634160|36.858105| |3.496639|4.753985|2.810309|2.459604|2.100669|1.870953|1.671609|1.641073|1.793222|2.040519|3.032808|1.816824|2.637130|1.369737|4.170220|6.556602|6.014622|7.403546|12.931143|36.858105| |2.910067|3.877429|2.366022|2.122923|1.843246|1.666887|1.503551|1.475105|1.595891|1.790936|2.712620|1.616252|2.391777|1.251976|3.261101|5.246897|4.345943|5.059200|7.993855|14.154043|53.358707| |2.640402|3.562612|2.201611|2.027102|1.766587|1.599748|1.447097|1.422220|1.538255|1.721322|2.622890|1.565222|2.312028|1.211175|3.004175|4.931007|3.915203|4.658492|7.379307|8.374154|19.616632|36.858105| |2.677867|3.703027|2.286821|2.141228|1.855915|1.666985|1.503686|1.481675|1.612712|1.814595|2.751160|1.650816|2.401515|1.252475|3.195029|5.324791|4.171142|5.211372|8.358053|6.930751|10.961603|14.579904|53.358707| |3.106452|4.437047|2.677631|2.488357|2.119586|1.870761|1.671561|1.650186|1.817635|2.076383|3.088202|1.867615|2.650301|1.370277|4.033082|6.716434|5.570909|7.941500|14.882114|7.899178|9.484856|8.443614|19.285822|53.358707| |2.233353|2.979636|1.886341|1.758597|1.556331|1.428004|1.303406|1.280609|1.372713|1.517352|2.350019|1.394331|2.098704|1.107213|2.437345|4.047588|3.012139|3.406964|4.664477|5.237230|10.807042|12.671053|10.894940|7.166976|36.858105| |2.109612|2.776183|1.773196|1.641307|1.463807|1.353796|1.241041|1.217651|1.297499|1.425206|2.222601|1.312292|2.003220|1.061563|2.226934|3.687175|2.698692|2.956937|3.839524|4.611979|9.310624|7.580287|7.094199|5.439243|13.636502|36.858105| |1.846791|2.428856|1.575792|1.473363|1.327402|1.237415|1.141665|1.120605|1.187473|1.294024|2.040121|1.200287|1.854001|0.987087|1.922548|3.212173|2.266187|2.445044|3.024599|3.458752|6.229886|5.043732|5.424562|4.326566|7.937310|13.832066|36.858105| |1.716171|2.273958|1.485786|1.406991|1.272276|1.187862|1.098809|1.079967|1.143510|1.242742|1.968870|1.158599|1.790829|0.954346|1.800811|3.035370|2.099258|2.271733|2.769434|3.004672|5.165152|4.431779|5.179678|4.099796|6.815549|7.891233|13.685033|36.858105| |1.781224|2.382047|1.550567|1.478708|1.331530|1.236976|1.141320|1.123076|1.193883|1.302295|2.055572|1.213733|1.857913|0.987033|1.906873|3.227052|2.237402|2.458011|3.036704|3.161766|5.391468|5.023928|6.223855|4.705534|7.904491|6.869754|7.976766|13.766772|36.858105| |2.016116|2.710917|1.739709|1.650862|1.471043|1.354596|1.241748|1.221970|1.307234|1.437947|2.244907|1.331386|2.009894|1.062333|2.206656|3.716384|2.656399|2.988281|3.879412|3.982340|7.069963|7.585326|9.339268|6.292569|13.762141|7.943359|6.913253|7.915783|13.707453|36.858105| |1.642194|2.209679|1.452667|1.401910|1.269784|1.182989|1.095582|1.079648|1.145781|1.244711|1.977696|1.166987|1.791543|0.953218|1.762714|3.010766|2.032647|2.222760|2.663402|2.678606|4.335911|3.937438|5.275162|4.168153|5.271626|4.609359|5.194533|7.854120|13.978980|8.179748|73.516695| |1.478670|1.983614|1.317127|1.274639|1.163747|1.091398|1.016039|1.001353|1.057481|1.141403|1.828886|1.075314|1.669310|0.891824|1.565232|2.680987|1.776667|1.916002|2.238971|2.272531|3.605884|3.111014|4.121569|3.409168|3.974968|3.788039|4.511522|6.724638|7.984082|5.258913|24.302952|36.858105| |1.386944|1.871997|1.252560|1.224104|1.123029|1.055186|0.985409|0.972698|1.026153|1.103954|1.778643|1.045406|1.625595|0.869290|1.474654|2.544743|1.652837|1.778058|2.036304|2.020840|3.114701|2.663262|3.661770|3.115370|3.193256|2.974627|3.337726|4.401440|5.216230|4.087364|14.398700|12.501053|36.858105| |1.259722|1.695909|1.143480|1.119416|1.033683|0.976783|0.916240|0.904337|0.949822|1.016330|1.648658|0.965678|1.517360|0.814454|1.324537|2.288930|1.468200|1.563006|1.762307|1.762107|2.684232|2.231251|3.034876|2.644961|2.620190|2.528281|2.863911|3.618578|3.902585|3.160373|9.152155|7.583152|12.661399|36.858105| |1.173616|1.587538|1.077257|1.056183|0.980858|0.927961|0.874077|0.865388|0.908690|0.968363|1.583259|0.928249|1.456924|0.782408|1.239316|2.154516|1.362321|1.453229|1.621473|1.617629|2.438073|2.003473|2.734077|2.417966|2.307449|2.237655|2.503266|3.054048|3.237312|2.716532|7.193569|5.361271|7.591139|14.444444|36.858105| |3.838194|5.152610|3.031310|2.562940|2.191640|1.952654|1.742196|1.707836|1.864701|2.123900|3.143375|1.876647|2.738650|1.421732|4.422540|6.817939|6.138905|6.688812|8.116013|15.551412|11.417525|5.561058|6.527912|7.396328|4.079760|3.881305|3.041854|2.629402|2.690983|3.227261|4.115942|2.014075|1.803557|1.598420|1.478169|73.516695| |17.517171|12.268596|6.466330|4.584804|3.575720|3.208920|2.655486|2.441152|2.594128|3.093675|4.064554|2.289138|3.733845|1.945573|6.261261|8.272257|5.747092|4.027328|3.475786|3.516725|3.985944|2.594179|3.493885|3.983583|2.209175|2.123801|1.858353|1.708715|1.752829|1.972488|2.854128|1.451806|1.354046|1.234216|1.151423|7.179419|0.500000| |17.670229|12.365097|5.653818|4.630509|3.432325|3.040268|2.499226|2.300493|2.459594|2.960588|3.868741|2.198928|3.522474|1.835040|7.115486|8.773415|7.543620|4.722329|4.111981|3.935787|4.451812|2.973649|4.111028|4.780530|2.484894|2.325105|2.016337|1.870569|1.951266|2.230270|3.180797|1.598962|1.493180|1.348225|1.248462|7.479022|0.301415|0.500000| |17.570838|12.508637|7.328663|5.963937|4.289765|3.906422|3.063480|2.705767|2.824924|3.435684|4.291875|2.362623|4.052735|2.121652|5.760142|7.927229|4.941618|3.546038|3.064213|2.945169|3.449090|2.342487|3.245569|3.691960|2.024765|1.921107|1.705743|1.598065|1.656535|1.853837|2.739333|1.397661|1.319137|1.204782|1.124080|5.627766|0.300777|0.303443|0.500000| |5.814799|12.534056|17.650009|8.852341|7.042488|5.010976|3.991539|3.888830|4.669491|6.552785|6.933809|3.990329|5.539182|2.671524|7.530607|14.292106|4.775543|3.904402|3.032487|2.795548|3.186524|2.172000|3.069583|3.607088|1.858643|1.748836|1.553816|1.463971|1.526685|1.712592|2.542492|1.297343|1.233984|1.126842|1.065358|5.400831|0.149065|0.128141|0.147469|0.500000| |7.579116|12.532735|17.555203|8.820092|6.737310|5.618433|4.202916|3.726815|4.012760|5.169044|5.814517|3.142309|5.317977|2.681330|5.845766|9.264098|4.245281|3.320006|2.738326|2.608714|3.032498|2.058895|2.866286|3.286683|1.786586|1.700753|1.519937|1.428352|1.478250|1.644763|2.459353|1.261874|1.198014|1.099215|1.036100|5.069787|0.195709|0.148741|0.221285|0.303171|0.500000| |5.809369|9.328918|8.828821|17.533370|8.893353|7.186830|4.717142|3.954848|4.185322|5.615640|5.864803|3.113807|5.497642|2.782972|5.123849|8.496366|3.898568|3.115653|2.607081|2.377644|2.828021|1.992346|2.856534|3.279134|1.741177|1.628267|1.466892|1.403300|1.473573|1.639496|2.487555|1.274691|1.225056|1.122018|1.055935|4.376542|0.128623|0.136177|0.191898|0.173874|0.214917|0.500000| |5.058792|9.782742|8.929695|17.586641|8.911138|5.753275|4.247963|3.980293|4.713444|7.045088|6.762592|3.811539|5.554658|2.694717|6.473415|12.387520|4.479030|3.700860|2.937051|2.574423|3.013029|2.139386|3.130656|3.696628|1.841789|1.698383|1.520162|1.458935|1.546642|1.738120|2.614769|1.330281|1.281351|1.166231|1.099914|4.678852|0.114669|0.124540|0.141736|0.210192|0.174562|0.302972|0.500000| |3.690190|5.407329|5.209050|6.925443|8.947249|17.703623|8.911805|5.647803|4.948272|5.655006|6.519220|3.143503|7.442336|3.923736|3.257200|5.701810|2.665888|2.279664|1.980714|1.861732|2.268482|1.598714|2.258790|2.519679|1.431798|1.360855|1.245529|1.194953|1.242081|1.357693|2.110433|1.096461|1.059007|0.981346|0.930166|3.453293|0.093013|0.088662|0.119254|0.125083|0.156155|0.216725|0.145874|0.500000| |2.577994|3.788259|3.464710|4.083868|5.652661|8.922926|17.752463|8.950119|5.635998|4.976050|7.590975|3.331228|12.548119|7.523883|2.454069|4.464836|2.073781|1.859029|1.639925|1.553637|1.917925|1.357734|1.912161|2.106454|1.231880|1.178036|1.088828|1.049085|1.086515|1.176111|1.857284|0.972725|0.944412|0.881217|0.841255|2.876117|0.067961|0.063959|0.078333|0.092984|0.101388|0.112467|0.098110|0.217052|0.500000| |3.445343|6.158831|6.032131|7.126059|8.935775|5.690181|4.975489|5.628746|8.949770|17.746726|12.591299|7.561830|7.580379|3.330407|4.458648|9.740458|3.318944|3.043437|2.456549|2.207914|2.611559|1.845397|2.667061|3.092630|1.612008|1.504621|1.359050|1.304656|1.372663|1.525088|2.328794|1.195597|1.155227|1.059144|1.009038|4.072583|0.087470|0.084921|0.094121|0.201050|0.137111|0.143260|0.209853|0.124612|0.107958|0.500000| |2.449344|4.052197|3.491540|3.879526|4.583714|3.756305|3.798142|4.743428|7.044111|6.764312|16.431871|17.559983|7.492419|3.231965|3.081607|6.583057|2.532782|2.482188|2.082118|1.877712|2.272039|1.629658|2.364184|2.692348|1.446845|1.351384|1.234311|1.196068|1.260503|1.387643|2.160807|1.116435|1.088435|1.002383|0.962703|3.409813|0.063854|0.062942|0.066787|0.110150|0.086052|0.090351|0.116192|0.086914|0.088126|0.227916|0.500000| |2.597581|4.326463|3.832576|3.893271|4.596418|3.768942|3.812515|4.763368|7.072684|6.780474|16.431918|17.562966|7.517878|3.242803|3.252179|6.938325|2.634027|2.563252|2.134641|1.961952|2.351894|1.658268|2.369938|2.697970|1.467317|1.383115|1.258612|1.208222|1.263035|1.390536|2.146659|1.109815|1.073567|0.989727|0.950051|3.640294|0.069403|0.065440|0.069942|0.129219|0.096217|0.089164|0.110163|0.087155|0.088420|0.227343|0.299400|0.500000| |2.124595|3.403595|2.903001|3.060690|3.616863|3.193704|3.417371|4.406466|5.892361|4.924175|17.018442|17.636466|7.753969|3.338096|2.553833|5.268646|2.160979|2.134450|1.831228|1.688523|2.062393|1.471468|2.107011|2.362161|1.320354|1.246331|1.145338|1.107963|1.158838|1.265099|1.986285|1.033237|1.006743|0.932640|0.899533|3.092909|0.056772|0.054576|0.058003|0.091675|0.074708|0.073554|0.087309|0.075212|0.082033|0.147272|0.299874|0.299792|0.500000| |1.993670|2.932187|2.552464|2.912216|3.737115|4.582777|6.754761|7.055821|4.750807|3.799179|7.508110|3.233423|16.450462|17.539577|1.987618|3.685085|1.722821|1.593531|1.423115|1.347465|1.681531|1.200242|1.693961|1.850308|1.099194|1.051918|0.979559|0.949604|0.983855|1.058090|1.693300|0.891544|0.870945|0.816317|0.783661|2.473468|0.053041|0.050775|0.058859|0.070944|0.072211|0.078719|0.075036|0.113549|0.226585|0.088185|0.084737|0.081794|0.084077|0.500000| |1.821378|2.687925|2.319277|2.538245|3.175811|3.616528|4.915101|5.888493|4.402289|3.412524|7.749845|3.334328|17.034166|17.631473|1.850152|3.460870|1.613542|1.513182|1.354473|1.289434|1.611224|1.147180|1.613026|1.757312|1.052951|1.011204|0.943101|0.913175|0.943497|1.012455|1.622847|0.856166|0.835840|0.784791|0.755714|2.375350|0.049148|0.046467|0.052846|0.066184|0.065551|0.067179|0.066156|0.089194|0.146757|0.081976|0.083980|0.084226|0.090425|0.299940|0.500000| |2.071190|3.032364|2.677297|2.917081|3.739588|4.585067|6.757397|7.064250|4.756473|3.802486|7.515432|3.239833|16.451368|17.540241|2.032955|3.748419|1.755134|1.616130|1.440976|1.378848|1.714591|1.212570|1.697605|1.853937|1.108967|1.067465|0.992262|0.956315|0.985779|1.060199|1.687684|0.888765|0.863854|0.809948|0.777299|2.559608|0.056096|0.052065|0.060955|0.075392|0.077871|0.077859|0.073356|0.113541|0.226232|0.088249|0.081686|0.085205|0.084256|0.299197|0.299930|0.500000| |6.490307|9.326836|4.587739|4.064649|3.099235|2.651085|2.242671|2.144452|2.366869|2.852474|3.834144|2.262182|3.320832|1.705566|8.976382|11.187651|17.496376|8.844070|6.941945|5.426618|5.732573|3.966312|5.904845|7.775468|3.080431|2.721946|2.297410|2.150506|2.314864|2.757800|3.759551|1.840890|1.718171|1.520951|1.403198|9.175511|0.147762|0.233647|0.141914|0.115944|0.109545|0.111119|0.123539|0.074103|0.056816|0.086059|0.066450|0.067281|0.056406|0.047160|0.043692|0.047485|0.500000| |7.080272|9.639042|4.695472|3.735853|2.956005|2.551916|2.186996|2.104804|2.320051|2.760617|3.787228|2.239021|3.280005|1.686049|8.891160|10.787069|17.611293|8.917758|7.031842|6.757216|6.428215|3.993663|5.440722|6.808722|3.087616|2.840767|2.364839|2.149874|2.251950|2.656176|3.589902|1.773331|1.633189|1.456719|1.349739|13.936724|0.190274|0.228815|0.141216|0.123845|0.117018|0.099362|0.106816|0.070930|0.055546|0.083084|0.064160|0.068104|0.056117|0.046027|0.043327|0.047454|0.302925|0.500000| |4.024907|6.466441|3.815168|3.233297|2.722312|2.307946|2.043409|2.047021|2.327963|2.733188|3.952526|2.449524|3.236525|1.637336|6.882442|12.091372|8.910506|17.569562|8.937298|6.807856|6.390474|4.168509|6.028806|8.258009|3.148624|2.810609|2.340879|2.159174|2.302030|2.750542|3.699294|1.812734|1.680999|1.488543|1.393540|12.291573|0.108386|0.115903|0.092001|0.112278|0.092128|0.081807|0.097332|0.061899|0.051448|0.086241|0.071077|0.075561|0.062052|0.044344|0.042594|0.045428|0.174174|0.214484|0.500000| |3.873627|6.295366|3.717169|3.405668|2.809400|2.363489|2.075398|2.070692|2.359490|2.799858|3.982495|2.465763|3.258183|1.646977|6.813925|12.455384|8.820537|17.614157|8.986499|5.512991|5.763381|4.188529|6.792058|10.475662|3.170256|2.714735|2.289478|2.173485|2.386807|2.889850|3.912811|1.896250|1.784089|1.564875|1.459429|8.700223|0.097680|0.115681|0.091474|0.105176|0.087559|0.087226|0.108314|0.063534|0.052149|0.088820|0.073799|0.073986|0.062142|0.045132|0.042745|0.045227|0.211735|0.174229|0.301781|0.500000| |2.233670|2.917166|1.854678|1.694400|1.508684|1.394654|1.276600|1.251225|1.333313|1.466611|2.279955|1.344935|2.055484|1.088822|2.331764|3.828935|2.840639|3.080436|3.982726|5.160945|10.718122|7.082841|6.520963|5.322843|8.941382|17.778221|8.895891|5.617554|4.955179|5.665634|6.508221|3.131066|2.549177|2.219312|1.993787|7.975829|0.063334|0.068235|0.056064|0.050886|0.049652|0.046597|0.048393|0.038957|0.033642|0.042987|0.038299|0.039575|0.035427|0.029892|0.028780|0.030509|0.078326|0.085145|0.082503|0.076749|0.500000| |1.758864|2.301158|1.503081|1.401744|1.269576|1.189266|1.100734|1.079860|1.140095|1.237253|1.959956|1.149658|1.791436|0.956538|1.803025|3.012858|2.098946|2.233794|2.696240|3.114166|5.406945|4.105932|4.519567|3.763101|5.641911|8.951756|17.690655|8.933708|5.668823|4.970764|7.445458|3.907978|2.978768|2.656953|2.355868|5.042172|0.049579|0.052960|0.045305|0.041205|0.040551|0.038798|0.039923|0.033291|0.029242|0.035962|0.032700|0.033500|0.030532|0.026340|0.025418|0.026770|0.058736|0.061372|0.060090|0.057913|0.214131|0.500000| |1.572928|2.082767|1.373140|1.305816|1.188475|1.115240|1.035995|1.018514|1.074486|1.161784|1.853273|1.087791|1.695150|0.906167|1.636157|2.769164|1.879318|2.013911|2.395569|2.576899|4.276238|3.546276|4.279433|3.511060|4.924448|5.638380|8.911839|17.745024|8.857926|5.621156|12.460236|7.442435|4.677012|4.024979|3.365423|4.097115|0.043569|0.047315|0.040976|0.037595|0.036815|0.036236|0.037502|0.031186|0.027559|0.033763|0.031140|0.031428|0.028980|0.025061|0.024133|0.025227|0.053430|0.053414|0.053506|0.053823|0.123933|0.216513|0.500000| |2.043714|2.779769|1.784274|1.709219|1.519684|1.393631|1.275801|1.257428|1.349715|1.488449|2.319018|1.379430|2.065070|1.088713|2.283778|3.875500|2.744649|3.129798|4.038491|3.874637|6.459938|7.022404|10.615579|6.984420|8.937224|5.649091|4.977922|5.650148|8.937833|17.781314|13.427763|4.866078|4.106693|3.121354|2.700781|5.541577|0.054886|0.062861|0.052286|0.048777|0.046495|0.047102|0.050444|0.038718|0.033487|0.044006|0.040181|0.039898|0.036371|0.030176|0.028806|0.030080|0.080003|0.074512|0.078806|0.086256|0.124529|0.107911|0.123920|0.500000| |1.474989|1.961080|1.301271|1.258377|1.148016|1.080759|1.005291|0.987186|1.038621|1.120749|1.790799|1.048428|1.645257|0.881401|1.535052|2.612637|1.741817|1.851805|2.156583|2.213471|3.514828|2.979311|3.883634|3.241465|3.801389|3.758625|4.607662|6.800786|7.076673|4.787983|16.544513|17.506046|8.826557|6.964513|4.857187|3.515773|0.040312|0.044402|0.038849|0.035459|0.034781|0.035110|0.036326|0.030270|0.026797|0.032488|0.030176|0.030053|0.027951|0.024498|0.023486|0.024447|0.050333|0.048608|0.048593|0.050584|0.087007|0.113649|0.226440|0.120227|0.500000| |1.423036|1.913804|1.275518|1.229533|1.127139|1.057360|0.987310|0.975629|1.030780|1.109506|1.788285|1.053052|1.630216|0.870867|1.510656|2.596785|1.707707|1.850118|2.154177|2.210594|3.510237|2.975190|3.878175|3.237657|3.796120|3.755200|4.606412|6.802841|7.067733|4.779730|16.523388|17.527280|8.843907|6.843633|5.408832|3.510572|0.039021|0.042502|0.037306|0.035055|0.034004|0.034035|0.035566|0.029446|0.026260|0.032302|0.030290|0.030238|0.028178|0.024131|0.023263|0.024122|0.048661|0.047545|0.049145|0.050676|0.086940|0.113677|0.227212|0.120010|0.301254|0.500000| |1.376826|1.873520|1.256524|1.229269|1.130081|1.058725|0.990290|0.981164|1.038367|1.116314|1.806037|1.065685|1.641219|0.875619|1.484743|2.580060|1.659524|1.805179|2.061548|2.025234|3.099806|2.662066|3.717112|3.175263|3.138592|2.874355|3.149490|4.039926|4.887163|4.019681|13.036014|8.907423|17.567265|8.898475|7.191713|3.205674|0.037293|0.041035|0.036304|0.034528|0.033273|0.034029|0.035865|0.029412|0.026315|0.032551|0.030872|0.030391|0.028558|0.024346|0.023413|0.024126|0.047691|0.045299|0.047564|0.050658|0.068807|0.077862|0.115540|0.115516|0.173814|0.214176|0.500000| |1.431501|1.928897|1.287977|1.264902|1.156899|1.087226|1.012837|0.997290|1.051304|1.133449|1.817011|1.066061|1.663458|0.889790|1.517530|2.612262|1.702618|1.820688|2.081238|2.042556|3.126980|2.691072|3.764808|3.211189|3.172956|2.895261|3.164910|4.061371|4.952005|4.081273|13.338520|8.955825|17.529870|8.921578|5.925886|3.230038|0.038611|0.042987|0.037916|0.035101|0.034168|0.035290|0.036857|0.030370|0.026966|0.032916|0.030910|0.030351|0.028454|0.024820|0.023729|0.024543|0.049625|0.046515|0.047396|0.050979|0.069234|0.078056|0.115582|0.117761|0.211989|0.174482|0.302837|0.500000| |1.248947|1.670986|1.126543|1.102708|1.017885|0.964915|0.904667|0.890334|0.932214|0.997180|1.614163|0.942190|1.493706|0.803655|1.297357|2.232005|1.437215|1.515308|1.705025|1.715847|2.613528|2.152652|2.902451|2.539746|2.526838|2.475709|2.828378|3.537481|3.690759|2.993944|8.258091|6.667874|8.647458|17.636966|9.213480|2.781032|0.034033|0.037174|0.033273|0.030743|0.030180|0.030808|0.031810|0.027006|0.024217|0.028780|0.027125|0.026818|0.025252|0.022395|0.021499|0.022233|0.041474|0.039772|0.040037|0.041963|0.060703|0.073853|0.111217|0.081098|0.199971|0.164004|0.171688|0.208447|0.500000| |1.170080|1.591881|1.081907|1.061212|0.987035|0.931686|0.878659|0.872504|0.918437|0.978142|1.604716|0.943725|1.470012|0.787969|1.248078|2.180410|1.369497|1.471875|1.639180|1.625803|2.440920|2.010942|2.765706|2.452543|2.297128|2.205568|2.434914|2.942265|3.168729|2.707651|7.021818|4.943883|6.868587|9.086826|17.689078|2.637038|0.031865|0.034498|0.031077|0.029815|0.028835|0.029376|0.030771|0.025871|0.023456|0.028379|0.027216|0.026827|0.025443|0.021904|0.021161|0.021715|0.039047|0.037559|0.039313|0.041231|0.054687|0.063317|0.088207|0.075656|0.118516|0.142648|0.214562|0.149698|0.173952|0.500000| 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