Version2.4 2021-05-03T22:50:41Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 03-Apr-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[C@H](CO)[NH2+]Cc1cc(c(cc1Br)OCC(=O)N)OCC C06702253 RHF 6-31G(d) (6D,7F) CC[C@H](CO)[NH2+]Cc1cc(c(cc1Br)OCC(=O)N)OCC C01[X(C15H24Br1N2O4)] 132 C1 393 CCOc1cc(C[NH2+][C@@H](CO)CC)c(cc1OCC(=O)N)Br CCOc1cc(C[NH2+][C@@H](CO)CC)c(cc1OCC(=O)N)Br CCOc1cc(C[NH2+][C@H](CC)CO)c(Br)cc1OCC(N)=O InChIKey=QCNFTRQFNHKZIL-LLVKDONJSA-O InChI=1S/C15H23BrN2O4/c1-3-11(8-19)18-7-10-5-13(21-4-2)14(6-12(10)16)22-9-15(17)20/h5-6,11,18-19H,3-4,7-9H2,1-2H3,(H2,17,20)/p+1/t11-/m1/s1 InChI=1/C15H23BrN2O4/c1-3-11(8-19)18-7-10-5-13(21-4-2)14(6-12(10)16)22-9-15(17)20/h5-6,11,18-19H,3-4,7-9H2,1-2H3,(H2,17,20)/p+1/t11-/m1/s1/fC15H24BrN2O4/h18H,17H2/q+1 CC[C@H](CO)[NH2+]Cc1cc(c(cc1Br)OCC(=O)N)OCC C01[X(C15H24Br1N2O4)] 132 C01 393 CCOc1cc(C[NH2+][C@@H](CO)CC)c(cc1OCC(=O)N)Br CCO[C]1[CH][C]([C]([CH][C]1OCC(=O)N)Br)C[NH2][C@@H](CO)CC CCO[C]1[CH][C](C[NH2][C@H](CC)CO)[C](Br)[CH][C]1OCC(N)=O InChIKey=HMTDWCYRTQWYEF-LLVKDONJSA-N InChI=1S/C15H24BrN2O4/c1-3-11(8-19)18-7-10-5-13(21-4-2)14(6-12(10)16)22-9-15(17)20/h5-6,11,19H,3-4,7-9,18H2,1-2H3,(H2,17,20)/t11-/m1/s1 InChI=1/C15H24BrN2O4/c1-3-11(8-19)18-7-10-5-13(21-4-2)14(6-12(10)16)22-9-15(17)20/h5-6,11,19H,3-4,7-9,18H2,1-2H3,(H2,17,20)/t11-/m1/s1/f/h17H2 2329.8499426686 -3560.0205205 1-A 11770.7267 97 296 393 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -490.19364 -64.60450 -58.74342 -58.74167 -58.74144 -20.71765 -20.69675 -20.68557 -20.60088 -15.83331 -15.65898 -11.44171 -11.43933 -11.43300 -11.42946 -11.42263 -11.41927 -11.41655 -11.39062 -11.38147 -11.37480 -11.37028 -11.35898 -11.35741 -11.34624 -11.29120 -9.85201 -7.60072 -7.59250 -7.59206 -3.33966 -3.33575 -3.33526 -3.32563 -3.32562 -1.54428 -1.52985 -1.51457 -1.46952 -1.46851 -1.29870 -1.29243 -1.23032 -1.18958 -1.17599 -1.13634 -1.12537 -1.11036 -1.08965 -1.04782 -1.01729 -0.98342 -0.97249 -0.94334 -0.92971 -0.91391 -0.88104 -0.86223 -0.84514 -0.82857 -0.82389 -0.81377 -0.79905 -0.79241 -0.78488 -0.78224 -0.76438 -0.75205 -0.74279 -0.73763 -0.73502 -0.71635 -0.70883 -0.69658 -0.68529 -0.68132 -0.67522 -0.67336 -0.64331 -0.64028 -0.63725 -0.63552 -0.62925 -0.62649 -0.62354 -0.62177 -0.59625 -0.59463 -0.59328 -0.57778 -0.56906 -0.54092 -0.53567 -0.49855 -0.48556 -0.45520 -0.41000 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.00737 0.02600 0.04766 0.06358 0.08973 0.09981 0.11802 0.12260 0.12816 0.13745 0.14332 0.14590 0.15132 0.16161 0.17313 0.17989 0.18552 0.19286 0.19550 0.19880 0.20590 0.21661 0.22027 0.22507 0.22641 0.23038 0.23734 0.24480 0.24818 0.26170 0.26555 0.27152 0.27283 0.27503 0.27945 0.28575 0.29501 0.32385 0.32950 0.33559 0.35260 0.36560 0.36899 0.41356 0.42299 0.42798 0.44229 0.49576 0.50339 0.51317 0.52606 0.53638 0.54232 0.54703 0.55826 0.56496 0.57057 0.58669 0.58887 0.59725 0.61844 0.63260 0.63785 0.65099 0.65932 0.66630 0.66843 0.68008 0.68580 0.68947 0.70131 0.70846 0.71097 0.71861 0.73908 0.73987 0.75081 0.75730 0.76639 0.77501 0.78339 0.79885 0.80211 0.80919 0.81751 0.83528 0.83712 0.84338 0.84934 0.86003 0.88197 0.89064 0.89406 0.90101 0.91561 0.92108 0.93055 0.94860 0.94939 0.96212 0.96952 0.97516 0.98270 0.98939 1.00157 1.00841 1.01256 1.02131 1.02506 1.02617 1.03473 1.04727 1.05081 1.06391 1.07031 1.07219 1.07386 1.08616 1.08892 1.09022 1.09575 1.10924 1.11345 1.11888 1.12020 1.12974 1.13271 1.14140 1.14401 1.15819 1.16311 1.17585 1.18706 1.19269 1.19924 1.20307 1.22335 1.24482 1.26186 1.27581 1.30095 1.31052 1.33587 1.34066 1.35706 1.36639 1.37384 1.38676 1.40672 1.41640 1.44634 1.45950 1.46720 1.48503 1.49548 1.50481 1.53418 1.54532 1.57119 1.57816 1.58584 1.61361 1.62671 1.64089 1.64918 1.65510 1.67210 1.69402 1.70739 1.71921 1.74292 1.74330 1.77638 1.78081 1.79516 1.82061 1.84063 1.85701 1.88382 1.88948 1.90020 1.91703 1.93346 1.95232 1.96662 1.97990 2.00044 2.00888 2.01644 2.02568 2.04151 2.04859 2.06537 2.07505 2.07792 2.08345 2.09737 2.12319 2.13377 2.14512 2.15155 2.16161 2.17397 2.17521 2.19464 2.20711 2.21873 2.22178 2.24791 2.25387 2.26543 2.28464 2.29784 2.32235 2.32700 2.34580 2.34659 2.35844 2.37948 2.39789 2.41059 2.42769 2.43805 2.44903 2.45619 2.46406 2.47416 2.49618 2.51128 2.52398 2.53016 2.55972 2.57319 2.57696 2.58278 2.59237 2.59566 2.60283 2.63188 2.64915 2.68821 2.69900 2.71502 2.73236 2.73727 2.78962 2.80301 2.81824 2.84705 2.85911 2.86127 2.89000 2.89156 2.91034 2.91331 2.94323 2.95251 2.96818 2.97847 2.99151 3.01712 3.05031 3.08825 3.11586 3.17874 3.22497 3.27130 3.29407 3.32844 3.37020 3.42434 3.62681 3.72483 4.05978 4.16648 4.21872 4.35118 4.39406 4.41340 4.44347 4.46640 4.51957 4.57678 4.59292 4.61661 4.64452 4.69867 4.71841 4.74559 4.79057 4.85523 4.86034 4.96102 5.40386 9.20397 75.30921 11.35712 12.1232 1.3449 -1.8841 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375.09194 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 15.3663 17.8592 25.6128 28.8747 43.3728 60.2375 69.4718 83.6311 95.5555 102.0539 110.9062 118.5338 130.4827 147.2376 185.4116 199.8575 212.7428 244.6375 247.4298 261.5348 272.9513 284.9085 303.3076 307.1734 314.7335 319.5212 343.6598 361.7689 433.1174 443.3323 451.3194 476.5601 509.2734 525.3994 556.3418 581.3963 656.5473 666.3650 682.2071 693.1598 741.7691 754.0021 794.5268 801.0755 848.6955 864.2803 904.0282 920.5416 929.8122 973.2057 973.9428 985.0839 998.0256 1000.0454 1048.7399 1057.9424 1094.0119 1095.4958 1113.9776 1122.8055 1141.0927 1162.8076 1198.5170 1210.0606 1225.1132 1245.7441 1250.1818 1268.5261 1277.4168 1299.2620 1301.6491 1334.5952 1369.7861 1384.8548 1392.5882 1400.5277 1417.0051 1429.0204 1432.4831 1446.7290 1465.3361 1485.0343 1498.8690 1520.5006 1536.5830 1547.7423 1563.1213 1567.5942 1582.2943 1586.2875 1595.1394 1604.9292 1611.8298 1626.5979 1630.0667 1641.8506 1642.7822 1645.7603 1647.4163 1657.5500 1674.3599 1691.1048 1707.2189 1767.9362 1780.2652 1802.1042 1805.4770 2017.7159 3203.0216 3205.6296 3214.4235 3225.3336 3229.0452 3233.0025 3244.8109 3255.3206 3262.0794 3272.3526 3280.8278 3287.8537 3295.2825 3299.8433 3300.3153 3311.7433 3369.5648 3403.1730 3432.5942 3663.8636 3732.7283 3829.5955 3956.0542 4106.8389 3.9220 6.4505 5.1630 4.9836 5.2859 4.4229 5.2768 1.8744 5.0815 3.0902 1.9354 3.9039 3.5704 3.8571 3.9824 4.7064 4.8712 2.9405 1.4911 4.7488 1.2353 3.2765 1.7076 1.2445 2.0916 2.3844 3.0503 3.9766 2.7321 4.3175 4.1841 3.1338 3.7930 2.9570 1.3793 4.8169 2.7572 4.3593 2.8684 4.5196 5.9267 3.3434 4.2917 3.3419 1.4285 1.8508 1.1013 3.4135 1.7535 2.7468 1.5899 2.1755 2.1880 1.6336 3.6285 2.2029 3.1295 1.6637 2.0485 2.0278 2.0106 3.5487 3.8425 1.9912 2.1105 2.2515 2.2658 2.0709 2.1523 1.5107 1.5012 2.4588 1.5169 1.3041 1.5290 1.2768 1.6208 1.3866 1.0989 2.0670 1.2237 1.4439 3.4389 1.2702 1.9859 1.2873 1.5187 1.5438 1.2227 1.3719 1.3864 1.7509 1.3851 1.0392 1.0599 1.0585 1.0947 1.1191 1.1131 1.0600 1.1431 1.0945 3.0789 7.9066 5.2084 1.0773 1.2226 10.0245 1.0555 1.0417 1.0567 1.0378 1.0618 1.0635 1.1101 1.1024 1.1086 1.0981 1.1030 1.0959 1.1024 1.0894 1.0742 1.1056 1.1087 1.0915 1.0927 1.0562 1.0953 1.0481 1.1046 1.0676 0.0005 0.0012 0.0020 0.0024 0.0059 0.0095 0.0150 0.0077 0.0273 0.0190 0.0140 0.0323 0.0358 0.0493 0.0807 0.1108 0.1299 0.1037 0.0538 0.1914 0.0542 0.1567 0.0926 0.0692 0.1221 0.1434 0.2123 0.3066 0.3020 0.5000 0.5021 0.4193 0.5796 0.4809 0.2515 0.9593 0.7002 1.1405 0.7865 1.2794 1.9213 1.1199 1.5962 1.2635 0.6062 0.8145 0.5303 1.7043 0.8932 1.5328 0.8886 1.2438 1.2841 0.9626 2.3513 1.4527 2.2069 1.1764 1.4978 1.5062 1.5425 2.8271 3.2520 1.7178 1.8664 2.0587 2.0865 1.9634 2.0693 1.5026 1.4986 2.5803 1.6769 1.4735 1.7470 1.4756 1.9175 1.6683 1.3286 2.5490 1.5481 1.8761 4.5520 1.7302 2.7626 1.8168 2.1863 2.2351 1.8036 2.0339 2.0785 2.6572 2.1202 1.6200 1.6593 1.6811 1.7406 1.7859 1.7799 1.7159 1.8881 1.8441 5.2872 14.5604 9.7258 2.0614 2.3480 24.0456 6.3803 6.3069 6.4329 6.3610 6.5227 6.5493 6.8864 6.8828 6.9505 6.9278 6.9950 6.9798 7.0530 6.9894 6.8937 7.1446 7.4170 7.4480 7.5857 8.3539 8.9916 9.0561 10.1858 10.6091 0.4675 1.8679 11.8312 1.3647 1.9434 1.8728 1.1028 0.2288 2.5405 7.3947 0.5193 1.2430 3.7146 6.1623 0.4440 9.5402 3.3019 1.9331 7.8321 3.6541 0.2833 4.1803 109.4599 152.9167 110.2880 33.4633 23.2839 5.2466 4.6558 5.5174 1.9425 5.0756 10.3705 4.4113 44.2963 14.2954 27.3751 25.3755 3.7366 4.3064 3.2330 44.7671 0.3676 2.0883 9.0867 18.6783 1.2218 23.8708 27.4964 10.3020 8.9956 6.6378 38.7245 42.6096 43.4823 8.1679 24.7857 3.6882 8.4230 7.6961 29.6354 80.8205 35.3925 21.6978 6.2124 25.3839 44.9152 20.7313 116.1806 5.5489 18.9736 130.2492 81.8955 84.6681 252.6066 23.8147 100.1453 28.2597 2.1792 225.7762 5.4972 26.7718 368.6435 19.4452 74.3728 13.3121 21.3494 58.3598 51.7921 57.4710 89.8633 8.6278 136.0865 5.5262 20.8800 2.9875 9.2267 68.7887 10.6135 31.6657 40.1494 3.9484 432.1917 3.5039 127.5882 43.6286 120.1083 388.3865 30.7258 23.0695 26.7484 21.7234 19.8077 20.2442 41.0502 11.0206 29.9617 4.5385 35.4129 35.7963 26.9331 10.2247 14.7204 27.9458 2.1767 6.4311 2.9121 40.9579 98.9765 89.7026 62.5165 149.8869 0.1204 0.5365 1.4304 0.3943 0.3600 1.4320 0.5201 0.2414 0.2587 0.0988 0.1905 0.1468 0.5996 0.2458 0.3543 1.9213 0.7502 1.1344 0.7256 6.3548 0.3172 1.4791 2.5626 1.2242 1.6920 0.7072 0.6280 0.3726 2.1690 1.9528 0.3530 1.2886 2.6908 0.3459 3.9483 0.2449 2.9526 3.3731 0.7989 3.3498 3.6282 1.7912 1.6557 3.1266 3.7591 7.7350 0.3092 1.6994 4.9142 15.8869 4.5914 8.6948 5.6836 4.2903 6.4741 8.8207 0.6614 2.6362 7.9095 2.0463 1.8617 11.7951 2.2172 4.0487 4.8516 10.5275 4.9027 1.2519 7.7196 1.2665 1.5873 22.1983 7.3622 6.7413 4.9126 8.3898 1.8113 3.1515 12.5631 6.0092 7.3732 7.4868 44.7119 6.0608 3.0166 1.5690 7.0931 15.6154 2.1365 6.2945 7.5216 1.5456 8.5012 22.0750 20.9719 15.7935 1.4856 17.9287 5.7079 14.9502 10.2601 8.0138 27.5055 27.0132 143.1368 17.3598 2.7686 8.3716 44.3471 98.9689 65.5278 147.5508 24.5530 131.9557 53.1000 90.8939 31.2818 19.8563 87.8332 46.7751 83.3326 120.6815 66.5442 42.8884 24.0344 61.0346 55.0405 24.8365 13.9400 119.5525 53.6213 94.6292 0.7120 0.7400 0.7435 0.7342 0.7421 0.7155 0.7500 0.6675 0.6367 0.7253 0.6483 0.6945 0.6306 0.7068 0.7344 0.1898 0.4927 0.6297 0.4175 0.2017 0.2032 0.3608 0.3062 0.7406 0.6980 0.4359 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0.3887 0.4793 0.6601 0.2003 0.7231 0.4695 0.6120 0.2263 0.2800 0.8439 0.4623 0.5184 0.2759 0.4947 0.7316 0.7918 0.8562 0.1096 0.5524 0.8405 0.8217 0.5638 0.3111 0.6941 0.6747 0.8568 0.6098 0.5124 0.2599 0.7452 0.8324 0.2010 0.8563 0.8069 0.2782 0.8140 0.8571 0.7845 0.8185 0.7780 0.7587 0.8569 0.5942 0.8536 0.6099 0.2222 0.7564 0.6662 0.8306 0.6182 0.6998 0.8045 0.8571 0.4056 0.7185 0.7950 0.8567 0.8571 0.8098 0.8104 0.7423 0.8428 0.8571 0.7265 0.8432 0.3474 0.4699 0.8036 0.6121 0.8548 0.6334 0.3205 0.0704 0.1453 0.0399 0.8535 0.1021 0.8536 0.8512 0.8559 0.4703 0.7880 0.3246 0.8551 0.3358 0.6287 0.8566 0.8155 0.4009 0.3942 0.0957 0.6811 0.2762 0.8489 0.4746 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 6 6 6 1 6 8 7 1 1 6 6 6 6 6 6 6 35 8 6 6 8 7 8 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 1.00783 12.00000 15.99491 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 78.91834 15.99491 12.00000 12.00000 15.99491 14.00307 15.99491 12.00000 12.00000 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 6052.8426 15918.1304 20380.1721 0.99987 0.01253 0.00997 -0.01226 0.99958 -0.02618 -0.01029 0.02606 0.99961 1 0.01431 0.00544 0.00425 0.29816 0.11338 0.08855 22.11 25.70 36.85 41.54 62.40 86.67 99.95 120.33 137.48 146.83 159.57 170.54 187.74 211.84 266.77 287.55 306.09 351.98 356.00 376.29 392.72 409.92 436.39 441.95 452.83 459.72 494.45 520.50 623.16 637.86 649.35 685.66 732.73 755.93 800.45 836.50 944.63 958.75 981.54 997.30 1067.24 1084.84 1143.15 1152.57 1221.08 1243.51 1300.69 1324.45 1337.79 1400.23 1401.29 1417.32 1435.94 1438.84 1508.90 1522.14 1574.04 1576.17 1602.77 1615.47 1641.78 1673.02 1724.40 1741.01 1762.66 1792.35 1798.73 1825.13 1837.92 1869.35 1872.78 1920.18 1970.82 1992.50 2003.62 2015.05 2038.75 2056.04 2061.02 2081.52 2108.29 2136.63 2156.54 2187.66 2210.80 2226.86 2248.98 2255.42 2276.57 2282.31 2295.05 2309.14 2319.06 2340.31 2345.30 2362.26 2363.60 2367.88 2370.26 2384.84 2409.03 2433.12 2456.31 2543.67 2561.40 2592.83 2597.68 2903.04 4608.43 4612.19 4624.84 4640.54 4645.88 4651.57 4668.56 4683.68 4693.40 4708.19 4720.38 4730.49 4741.18 4747.74 4748.42 4764.86 4848.05 4896.41 4938.74 5271.48 5370.56 5509.93 5691.88 5908.83 0.419895 0.443743 0.444687 0.361706 -3559.600626 -3559.576778 -3559.575834 -3559.658814 2.783163D-04 MUNgauss RevisionA2.1 retrievium 03-May-2021 DUDE CC[C@H](CO)[NH2+]Cc1cc(c(cc1Br)OCC(=O)N)OCC C06702253 RHF 6-31G(d) (6D,10F) C1 375.091944 |X|Y|Z| 53.825943 91.193901 23.609322 48.754382 6 6 6 |36.858105| |12.442118|36.858105| |7.372026|12.432330|36.858105| |6.788190|8.820211|17.593948|0.500000| |4.840320|7.479556|12.470174|0.245535|36.858105| |4.323089|6.289244|8.120493|0.161821|13.592560|73.516695| |6.268063|7.675069|12.638008|0.253519|7.762994|12.940021|53.358707| |7.361411|7.365880|9.221813|0.218655|5.724713|9.612882|25.706082|0.500000| |5.584263|7.046595|9.278080|0.181722|7.357521|15.442805|25.651960|0.325462|0.500000| |4.342108|4.912216|7.403449|0.194362|6.203774|10.303343|17.204458|0.258514|0.256553|36.858105| |3.671292|3.857570|4.922817|0.129247|4.302978|7.852035|10.476171|0.203316|0.197974|12.661031|36.858105| |3.025686|3.247347|3.968332|0.102032|3.803287|7.414179|7.533145|0.141020|0.161341|7.587489|13.560533|36.858105| |2.616849|2.718119|3.142546|0.082067|3.001647|5.825552|5.601699|0.111287|0.120192|5.026886|7.844150|13.856169|36.858105| |2.599754|2.591195|2.916014|0.077674|2.681489|5.052224|5.141233|0.108341|0.106771|4.424418|6.800174|7.917783|13.432406|36.858105| |2.967217|2.864553|3.231262|0.087638|2.836762|5.181238|5.828395|0.129691|0.115494|4.998897|7.887661|6.892022|7.886353|13.843708|36.858105| |3.605106|3.509931|4.162330|0.113606|3.496877|6.230844|8.137628|0.185490|0.151014|7.540437|13.878437|8.002094|6.869061|7.945168|13.675888|36.858105| |4.273464|3.790141|4.320578|0.126836|3.373605|5.639865|7.608452|0.195787|0.129918|5.991260|6.660143|4.578300|4.071765|4.608301|6.718622|9.995773|2539.412838| |2.240382|2.218686|2.432760|0.065075|2.271914|4.286236|4.095063|0.086243|0.085652|3.383408|4.615535|5.322575|8.208390|14.334745|7.935588|5.222513|123.859248|73.516695| |2.127603|2.057926|2.209889|0.059784|2.037272|3.785286|3.636070|0.078280|0.074992|2.916832|3.776165|3.990745|5.247081|8.030828|6.704909|4.501814|119.049340|24.254385|36.858105| |1.852680|1.803975|1.911011|0.051526|1.792947|3.354161|3.062969|0.065100|0.063883|2.412253|2.978058|3.216695|4.104779|5.257987|4.408129|3.343568|93.237098|14.342828|12.479701|36.858105| |1.805641|1.777098|1.874218|0.050030|1.779239|3.375174|2.994104|0.062972|0.063427|2.334615|2.853887|3.170914|4.068429|4.831126|3.915164|3.088568|85.484329|12.616108|8.008011|16.004744|73.516695| |1.697967|1.641097|1.727671|0.047047|1.619868|2.994130|2.718460|0.057943|0.056080|2.130896|2.556702|2.687218|3.261851|4.030894|3.646948|2.879421|84.644849|9.610207|7.880720|14.080111|15.070491|53.358707| |2.259580|2.365277|2.677436|0.069860|2.643596|5.202506|4.522773|0.088924|0.098499|3.877183|5.184566|7.928624|14.355037|8.202971|5.312334|4.649340|108.019255|13.245543|4.825751|4.179463|7.818763|4.468658|73.516695| |2.157200|2.318368|2.636979|0.068176|2.715362|5.467198|4.323228|0.082371|0.095671|3.668179|4.467871|6.661961|7.979148|5.219582|3.969169|3.785989|93.732006|8.540902|3.560522|3.255500|6.184587|3.653248|23.962727|36.858105| |1.857101|1.974664|2.189057|0.057103|2.257428|4.492896|3.466128|0.067119|0.076008|2.840526|3.323094|4.392899|5.249365|4.093259|3.204618|2.984192|78.222344|7.417422|3.258202|3.191220|6.292095|3.622711|14.355262|12.584247|36.858105| |17.594706|8.850753|5.445059|0.140910|4.058716|6.654566|6.408408|0.146721|0.123570|3.500309|3.070006|2.622548|2.322388|2.317068|2.601568|3.043451|120.292140|3.623218|1.955858|1.728713|3.008701|2.171074|3.633592|1.962060|1.716010|0.500000| |17.535434|8.666797|6.438742|0.161010|4.374151|7.377464|9.102508|0.247411|0.169787|4.583449|4.089742|3.317208|2.892777|2.925104|3.403581|4.152941|168.710071|4.440463|2.378479|2.046834|3.536829|2.533966|4.374544|2.306434|1.974170|0.304658|0.500000| |17.550062|8.745596|6.781042|0.203784|4.496137|6.811663|7.746337|0.185950|0.133184|4.275523|3.576963|2.901301|2.516687|2.528118|2.928937|3.587122|155.391076|3.876553|2.087338|1.809896|3.106443|2.277464|3.852875|2.059188|1.777745|0.302389|0.300873|0.500000| |8.791235|17.552661|8.858661|0.173604|6.923227|12.475754|9.452427|0.180608|0.207793|4.533216|3.734737|3.269875|2.758990|2.598535|2.809069|3.358755|116.780985|3.981662|2.064700|1.825628|3.231988|2.245754|4.319750|2.404532|2.051833|0.210003|0.210148|0.172145|0.500000| |8.894824|17.565758|9.026317|0.214201|6.995875|9.867027|7.636079|0.147476|0.144883|4.084703|3.250156|2.809992|2.387909|2.275559|2.485799|2.977113|109.930543|3.518903|1.847474|1.638340|2.872474|2.046280|3.761970|2.097873|1.812423|0.218567|0.172594|0.208594|0.304522|0.500000| |4.620937|7.163808|8.920183|0.204315|17.584233|16.381189|7.670043|0.127811|0.150664|4.638042|3.470403|3.128172|2.566230|2.331442|2.459886|2.950375|99.952658|3.583457|1.832452|1.632037|2.883260|2.024833|4.097948|2.374460|2.022957|0.112663|0.111252|0.120110|0.183428|0.221025|0.500000| |4.027146|5.483627|8.778482|0.220897|17.559546|16.467437|9.147826|0.140860|0.169609|6.578570|4.420278|3.941824|3.069798|2.709826|2.848381|3.518477|113.650584|4.071122|2.040563|1.792590|3.150731|2.208912|4.813755|2.805963|2.318866|0.094931|0.103596|0.109049|0.139427|0.146006|0.302057|0.500000| |3.637319|5.023324|5.964144|0.130740|9.724507|35.705227|7.301234|0.118396|0.171187|4.675669|3.761716|3.707673|2.998305|2.588288|2.605597|3.044180|93.705323|3.976973|1.978581|1.777568|3.200253|2.167631|4.905492|2.975585|2.488670|0.090628|0.096615|0.091024|0.155654|0.131703|0.230538|0.219692|0.500000| |3.783956|4.509783|6.785271|0.172897|6.996444|11.971446|12.390731|0.181901|0.224380|17.688860|8.903272|7.339992|4.803929|3.985272|4.188236|5.609760|152.965876|5.586824|2.679036|2.269128|3.957009|2.731208|6.931985|3.910098|2.991405|0.087465|0.107376|0.102383|0.119130|0.108411|0.140138|0.228978|0.153689|0.500000| |4.290687|4.658479|6.945567|0.216142|5.604918|8.498071|12.418079|0.221368|0.181289|17.648543|8.823107|5.743521|4.232475|3.943916|4.612828|6.847076|224.035919|5.509300|2.750418|2.277434|3.868134|2.787613|5.968942|3.159392|2.529204|0.095855|0.122246|0.124719|0.113672|0.111360|0.122689|0.172180|0.111132|0.300598|0.500000| |2.901421|3.234526|4.009969|0.101400|4.118646|8.342148|7.232711|0.127690|0.160332|7.104124|8.909212|17.759896|8.986985|5.633698|4.965249|5.689673|129.688003|7.630800|3.333768|2.820473|5.042052|3.257693|12.643071|7.434410|4.680122|0.070387|0.086164|0.076791|0.091606|0.078821|0.093159|0.121027|0.118319|0.227770|0.148454|0.500000| |2.818934|2.644917|2.899671|0.079787|2.529419|4.560889|5.007794|0.113907|0.098366|4.092496|5.651562|4.968542|5.609835|8.925538|17.798287|8.946473|223.709276|12.559472|7.403197|4.667453|7.024797|5.437256|7.603569|3.314626|2.806830|0.069622|0.089989|0.078202|0.071647|0.064421|0.062076|0.070164|0.064226|0.096514|0.109592|0.107847|0.500000| |2.074432|1.996955|2.159166|0.059299|1.984149|3.625464|3.516372|0.075840|0.071119|2.866324|3.660021|3.743826|4.696312|6.920830|6.505847|4.457119|122.490556|16.557200|17.553507|8.747312|10.484043|10.149711|7.540175|3.235204|2.956922|0.052857|0.063907|0.057336|0.054965|0.050087|0.049705|0.055683|0.052647|0.072839|0.076904|0.087292|0.214494|0.500000| |2.283880|2.171232|2.296162|0.061876|2.082039|3.868237|3.797582|0.083504|0.078443|2.958507|3.801866|3.855182|4.810941|7.213470|6.958719|4.689208|128.272817|16.485965|17.549652|8.995898|11.937176|8.976761|7.582751|3.255195|2.947379|0.058436|0.072031|0.061937|0.060627|0.053770|0.052095|0.057217|0.055776|0.074258|0.077359|0.089261|0.232832|0.300194|0.500000| |1.694503|1.629932|1.722223|0.047301|1.607490|2.941222|2.700909|0.057765|0.055109|2.132408|2.548360|2.630530|3.140253|3.914792|3.677706|2.910405|87.221494|8.931197|7.341653|9.231731|10.826675|26.096735|5.491447|2.539969|2.484141|0.044123|0.051474|0.046774|0.045162|0.041561|0.041038|0.044918|0.043373|0.055512|0.057627|0.064867|0.114850|0.229687|0.171705|0.500000| |1.572702|1.525787|1.597773|0.043448|1.509583|2.796537|2.486834|0.052709|0.051503|1.935729|2.283158|2.412653|2.885614|3.414461|3.088795|2.519810|75.033706|7.843859|5.715842|9.457166|13.662301|26.019091|5.280552|2.496231|2.536413|0.041296|0.047616|0.042973|0.042754|0.039039|0.038721|0.041979|0.041568|0.051093|0.051679|0.060709|0.092073|0.149749|0.140096|0.311455|0.500000| |2.309643|2.522242|2.857408|0.072257|2.981705|6.243087|4.710025|0.088386|0.108024|3.864103|4.572448|6.743333|7.104226|4.773541|3.806405|3.763313|94.189607|7.589506|3.271865|2.988440|5.705017|3.375988|16.529058|17.542357|8.836652|0.058348|0.068652|0.060365|0.073970|0.062999|0.071945|0.084198|0.094711|0.115988|0.090001|0.225240|0.088340|0.082006|0.086049|0.065093|0.064322|0.500000| |2.144413|2.326804|2.704604|0.070708|2.832155|5.603043|4.381390|0.082162|0.094921|3.868363|4.568683|6.739254|7.077872|4.749971|3.794408|3.756572|94.022155|7.543437|3.242108|2.927750|5.402821|3.374313|16.522027|17.545152|8.834853|0.053902|0.062926|0.057426|0.066190|0.058905|0.068499|0.083433|0.085178|0.118528|0.093478|0.226805|0.088100|0.084686|0.082278|0.066355|0.064022|0.300189|0.500000| 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