# Number of dimensions 3 #INAME 1 1H #INAME 2 1H #INAME 3 15N 1 7.822 4.555 127.465 1 ? 1.368e+05 2.14e+01 a 0 1721 1700 1720 0 2 7.822 3.075 127.465 1 ? 8.975e+04 1.98e+01 a 0 0 0 0 0 3 7.822 2.906 127.465 1 ? 8.740e+04 1.92e+01 a 0 0 0 0 0 4 8.331 3.903 125.976 1 ? 2.787e+05 2.27e+01 a 0 546 540 545 0 5 8.331 4.486 125.976 1 ? 1.125e+05 2.01e+01 a 0 546 538 545 0 6 8.262 1.640 125.313 1 ? 1.341e+05 1.12e+01 a 0 0 0 0 0 7 8.262 4.381 125.313 1 ? 1.256e+05 9.23e+00 a 0 0 0 0 0 8 8.262 1.814 124.819 1 ? 1.538e+05 1.16e+01 a 0 173 152 172 0 9 8.262 4.274 124.819 1 ? 1.526e+05 7.77e+00 a 0 173 149 172 0 10 8.345 3.171 124.175 1 ? 1.643e+05 2.82e+01 a 0 0 0 0 0 11 8.345 4.645 124.175 1 ? 1.071e+05 1.89e+01 a 0 111 96 110 0 12 7.863 2.777 123.872 1 ? 1.668e+05 1.75e+01 a 0 674 665 673 0 13 7.861 4.731 123.872 1 ? 6.809e+04 9.28e+00 a 0 674 662 673 0 14 8.458 1.816 123.765 1 ? 1.736e+05 7.82e+00 a 0 265 242 264 0 15 8.458 4.351 123.765 1 ? 2.152e+05 7.73e+00 a 0 265 239 264 0 16 8.189 4.142 123.792 1 ? 1.297e+05 1.45e+01 a 0 1584 1572 1583 0 17 8.189 2.031 123.792 1 ? 1.122e+05 6.39e+00 a 0 1584 1575 1583 0 18 8.140 1.866 123.712 1 ? 8.976e+04 1.81e+01 a 0 1636 1613 1635 0 19 8.140 4.232 123.712 1 ? 1.017e+05 1.47e+01 a 0 0 0 0 0 20 8.537 3.999 123.532 1 ? 1.551e+05 1.64e+01 a 0 0 0 0 0 21 8.541 4.474 123.532 1 ? 7.535e+04 8.75e+00 a 0 1538 1530 1537 0 22 8.338 4.341 123.485 1 ? 3.833e+05 1.17e+01 a 0 0 0 0 0 23 8.436 1.824 123.285 1 ? 6.662e+04 3.96e+00 a 0 237 214 236 0 24 8.436 4.371 123.285 1 ? 6.685e+04 3.64e+00 a 0 0 0 0 0 25 8.393 4.289 123.338 1 ? 3.143e+05 1.15e+01 a 0 1906 1895 1905 0 26 8.214 3.851 123.087 1 ? 2.755e+05 2.42e+01 a 0 1698 1692 1697 0 27 8.217 4.487 123.087 1 ? -2.113e+04 3.54e+00 a 0 1698 1690 1697 0 28 8.357 2.025 122.859 1 ? 1.342e+05 1.60e+01 a 0 147 137 146 0 29 8.453 1.594 122.748 1 ? 1.615e+05 1.89e+01 a 0 133 116 132 0 30 8.453 4.340 122.748 1 ? 1.244e+05 4.70e+00 a 0 133 113 132 0 31 8.285 1.641 122.749 1 ? 1.622e+05 1.55e+01 a 0 0 0 0 0 32 8.285 4.424 122.749 1 ? 1.101e+05 3.34e+00 a 0 0 0 0 0 33 8.216 4.723 122.507 1 ? 1.083e+05 1.07e+01 a 0 403 388 402 0 34 8.216 3.260 122.507 1 ? 1.524e+05 5.87e+00 a 0 403 391 402 0 35 8.256 1.814 122.360 1 ? 1.612e+05 1.09e+01 a 0 209 188 208 0 36 8.256 4.318 122.360 1 ? 1.506e+05 5.04e+00 a 0 209 185 208 0 37 8.463 4.488 122.305 1 ? 2.545e+05 8.51e+00 a 0 2041 2025 2040 0 38 8.463 2.096 122.305 1 ? 2.325e+05 6.75e+00 a 0 0 0 0 0 39 8.021 1.446 121.923 1 ? 1.595e+05 1.61e+01 a 0 0 0 0 0 40 8.021 4.271 121.923 1 ? 1.150e+05 1.10e+01 a 0 1646 1638 1645 0 41 8.557 4.325 121.754 1 ? 1.242e+05 8.83e+00 a 0 0 0 0 0 42 8.557 1.840 121.754 1 ? 1.228e+05 5.40e+00 a 0 0 0 0 0 43 8.415 4.062 121.668 1 ? 1.280e+05 1.11e+01 a 0 386 367 385 0 44 8.415 2.297 121.668 1 ? 5.636e+04 2.49e+00 a 0 600 589 599 0 45 8.266 1.416 121.566 1 ? 2.461e+05 1.33e+01 a 0 0 0 0 0 46 8.266 4.366 121.566 1 ? 1.551e+05 9.24e+00 a 0 556 548 555 0 47 8.022 2.698 121.556 1 ? 2.202e+05 3.32e+01 a 0 319 314 318 0 48 8.022 4.563 121.556 1 ? 1.229e+05 2.20e+01 a 0 319 311 318 0 49 8.493 4.447 121.203 1 ? 2.125e+05 1.91e+01 a 0 2009 1995 2008 0 50 8.493 1.915 121.203 1 ? 7.908e+04 1.04e+01 a 0 2009 1998 2008 0 51 8.035 2.060 121.118 1 ? 1.246e+05 1.95e+01 a 0 1608 1599 1607 0 52 8.035 4.169 121.118 1 ? 1.366e+05 1.79e+01 a 0 1608 1596 1607 0 53 8.185 4.186 120.964 1 ? 1.281e+05 1.31e+01 a 0 1920 1908 1919 0 54 8.185 2.027 120.964 1 ? 1.048e+05 1.05e+01 a 0 1920 1911 1919 0 55 8.253 1.415 120.869 1 ? 2.044e+05 1.29e+01 a 0 183 176 182 0 56 8.253 4.311 120.869 1 ? 1.496e+05 1.19e+01 a 0 183 175 182 0 57 7.818 4.556 120.877 1 ? 2.069e+05 3.90e+01 a 0 2074 2066 2073 0 58 7.818 3.949 120.877 1 ? 4.840e+05 2.55e+01 a 0 2074 2069 2073 0 59 8.472 2.099 120.742 1 ? 1.090e+05 9.89e+00 a 0 1556 1543 1555 0 60 8.472 4.233 120.742 1 ? 1.186e+05 7.88e+00 a 0 1556 1540 1555 0 61 8.045 1.369 120.583 1 ? 1.649e+05 3.64e+01 a 0 1859 1852 1858 0 62 8.045 4.364 120.583 1 ? 1.177e+05 2.12e+01 a 0 1859 1851 1858 0 63 8.212 1.647 120.354 1 ? 1.655e+05 2.03e+01 a 0 0 0 0 0 64 8.212 4.332 120.354 1 ? 1.293e+05 8.09e+00 a 0 0 0 0 0 65 7.967 2.024 120.346 1 ? 1.315e+05 3.23e+01 a 0 0 0 0 0 66 7.967 4.224 120.346 1 ? 1.402e+05 2.19e+01 a 0 365 353 364 0 67 7.904 3.783 120.216 1 ? 3.695e+04 4.21e+00 a 0 1060 1055 1059 0 68 7.904 3.902 120.216 1 ? 4.441e+04 3.86e+00 a 0 1060 1052 1059 0 69 8.142 2.236 119.928 1 ? 5.014e+04 1.29e+01 a 0 0 0 0 0 70 8.142 4.401 119.928 1 ? 1.073e+05 9.31e+00 a 0 1505 1491 1504 0 71 8.142 1.838 119.928 1 ? 3.841e+04 7.65e+00 a 0 0 0 0 0 72 8.438 4.194 119.841 1 ? 2.007e+05 1.63e+01 a 0 1938 1922 1937 0 73 8.438 2.119 119.841 1 ? 9.477e+04 1.09e+01 a 0 1938 1924 1937 0 74 8.123 4.007 119.559 1 ? 3.048e+05 2.99e+01 a 0 1663 1659 1662 0 76 8.201 1.447 119.420 1 ? 1.571e+05 1.78e+01 a 0 0 0 0 0 77 8.201 4.304 119.420 1 ? 1.030e+05 1.09e+01 a 0 684 676 683 0 78 8.505 4.433 119.272 1 ? 1.700e+05 2.01e+01 a 0 309 295 308 0 79 8.505 2.313 119.272 1 ? 6.349e+04 1.38e+01 a 0 309 298 308 0 80 8.505 1.957 119.272 1 ? 5.743e+04 1.17e+01 a 0 0 0 0 0 81 8.436 4.422 119.015 1 ? 4.415e+05 3.04e+01 a 0 2064 2053 2063 0 82 8.436 4.818 119.015 1 ? 1.117e+04 2.27e+00 a 0 0 0 0 0 83 8.224 1.475 118.930 1 ? 1.629e+05 1.55e+01 a 0 0 0 0 0 84 8.224 4.202 118.930 1 ? 1.198e+05 1.06e+01 a 0 1594 1586 1593 0 85 8.507 4.717 118.004 1 ? 2.075e+04 4.45e+00 a 0 996 975 995 0 86 8.507 2.567 118.004 1 ? 2.251e+04 2.71e+00 a 0 996 978 995 0 87 8.502 4.029 118.061 1 ? 2.194e+04 1.00e+01 a 0 1252 1228 1251 0 88 8.502 1.930 118.061 1 ? 2.908e+04 8.16e+00 a 0 1252 1231 1251 0 90 8.507 4.436 117.226 1 ? 1.470e+05 1.27e+01 a 0 0 0 0 0 91 8.507 2.339 117.226 1 ? 4.599e+04 1.13e+01 a 0 0 0 0 0 92 8.507 1.964 117.226 1 ? 4.980e+04 1.03e+01 a 0 0 0 0 0 93 8.232 3.909 116.241 1 ? 4.019e+05 2.16e+01 a 0 0 0 0 0 94 8.232 4.578 116.241 1 ? 1.618e+05 1.73e+01 a 0 1948 1940 1947 0 95 8.190 4.020 115.770 1 ? 3.797e+05 1.14e+01 a 0 0 0 0 0 97 8.140 4.010 115.669 1 ? 2.733e+05 1.13e+01 a 0 0 0 0 0 98 8.186 2.733 114.634 1 ? 4.282e+05 1.83e+01 a 0 0 0 0 0 99 8.186 4.719 114.634 1 ? 2.041e+05 1.58e+01 a 0 2051 2043 2050 0 100 8.481 4.349 110.509 1 ? 1.489e+05 2.19e+01 a 0 0 0 0 0 101 8.481 2.128 110.509 1 ? 1.552e+05 1.07e+01 a 0 529 516 528 0 102 8.451 4.550 109.922 1 ? 1.227e+05 1.51e+01 a 0 1681 1665 1680 0 103 8.451 2.166 109.922 1 ? 6.108e+04 6.61e+00 a 0 1681 1668 1680 0 104 8.163 4.307 107.260 1 ? 1.107e+05 2.85e+01 a 0 1656 1648 1655 0 105 8.163 1.472 107.260 1 ? 1.544e+05 2.34e+01 a 0 1656 1649 1655 0 106 9.306 2.798 130.408 1 ? 7.863e+03 3.69e+00 a 0 0 0 0 0 107 9.306 2.950 130.408 1 ? 1.024e+04 3.03e+00 a 0 0 0 0 0 108 8.993 4.457 123.154 1 ? 2.082e+04 9.09e+00 a 0 1226 1218 1225 0 110 8.775 3.855 121.166 1 ? 1.958e+04 7.84e+00 a 0 1073 1062 1072 0 111 8.775 4.133 121.166 1 ? 1.648e+04 5.54e+00 a 0 1073 1064 1072 0 112 8.792 4.155 120.027 1 ? 2.907e+04 9.66e+00 a 0 838 818 837 0 113 8.792 1.265 120.027 1 ? 2.516e+04 8.26e+00 a 0 838 821 837 0 114 8.942 1.429 118.016 1 ? 3.077e+04 1.19e+01 a 0 925 918 924 0 115 8.942 4.137 118.016 1 ? 1.955e+04 6.67e+00 a 0 925 917 924 0 116 8.798 4.754 117.053 1 ? 1.582e+04 5.87e+00 a 0 1019 998 1018 0 117 8.798 2.557 117.053 1 ? 1.107e+04 2.53e+00 a 0 0 0 0 0 120 7.585 4.133 122.825 1 ? 2.333e+04 6.51e+00 a 0 1148 1139 1147 0 121 8.117 3.064 126.916 1 ? 6.376e+04 2.63e+01 a 0 721 702 720 0 122 8.117 4.462 126.916 1 ? 5.209e+04 1.52e+01 a 0 0 0 0 0 123 7.946 4.129 119.784 1 ? 3.185e+04 6.77e+00 a 0 1407 1383 1406 0 124 7.946 1.947 119.784 1 ? 2.619e+04 5.47e+00 a 0 0 0 0 0 126 7.522 4.393 119.440 1 ? 1.140e+04 5.06e+00 a 0 1262 1254 1261 0 127 7.879 2.241 119.139 1 ? 2.142e+04 8.02e+00 a 0 1425 1412 1424 0 128 7.879 4.176 119.139 1 ? 1.963e+04 6.44e+00 a 0 0 0 0 0 129 7.599 3.871 118.988 1 ? 2.105e+04 8.12e+00 a 0 1381 1361 1380 0 130 7.601 1.588 118.988 1 ? 2.063e+04 4.94e+00 a 0 1381 1364 1380 0 131 7.736 3.985 118.987 1 ? 6.147e+04 1.17e+01 a 0 1457 1452 1456 0 132 7.736 4.403 118.987 1 ? 2.406e+04 5.07e+00 a 0 1457 1449 1456 0 133 7.986 2.860 118.474 1 ? 2.365e+04 6.62e+00 a 0 1109 1089 1108 0 134 7.986 1.827 118.474 1 ? 4.999e+03 2.83e+00 a 0 1109 1092 1108 0 135 7.836 4.110 118.355 1 ? 2.320e+04 5.99e+00 a 0 1359 1333 1358 0 136 7.836 1.959 118.355 1 ? 1.372e+04 3.61e+00 a 0 1359 1336 1358 0 137 7.288 3.964 118.079 1 ? 2.447e+04 8.95e+00 a 0 816 811 815 0 138 7.288 3.649 118.079 1 ? 2.039e+04 7.09e+00 a 0 816 812 815 0 139 7.639 4.111 117.391 1 ? 1.768e+04 8.63e+00 a 0 1279 1264 1278 0 140 7.639 2.971 117.391 1 ? 7.108e+03 2.32e+00 a 0 1279 1266 1278 0 141 7.828 4.423 117.172 1 ? 2.211e+04 8.79e+00 a 0 1216 1190 1215 0 142 7.828 2.090 117.172 1 ? 7.982e+03 5.61e+00 a 0 1216 1192 1215 0 143 7.197 3.817 115.484 1 ? 1.334e+04 6.05e+00 a 0 0 0 0 0 144 7.197 3.112 115.484 1 ? 1.594e+04 5.56e+00 a 0 1188 1170 1187 0 145 7.259 1.408 115.146 1 ? 3.939e+04 1.29e+01 a 0 0 0 0 0 146 7.259 3.898 115.146 1 ? 1.161e+04 5.29e+00 a 0 945 937 944 0 147 7.849 4.289 114.579 1 ? 3.319e+04 1.05e+01 a 0 1447 1427 1446 0 148 7.850 1.789 114.579 1 ? 3.627e+04 5.95e+00 a 0 1447 1430 1446 0 149 8.127 4.495 114.140 1 ? 1.789e+05 1.87e+01 a 0 0 0 0 0 150 8.127 2.361 114.140 1 ? 7.653e+04 1.21e+01 a 0 0 0 0 0 151 8.127 1.963 114.140 1 ? 7.118e+04 1.02e+01 a 0 0 0 0 0 152 8.331 4.095 113.706 1 ? 2.019e+04 4.81e+00 a 0 1050 1042 1049 0 153 8.117 4.149 108.710 1 ? 4.734e+04 1.36e+01 a 0 802 798 801 0 154 9.306 4.393 113.991 1 ? 2.360e+04 6.83e+00 a 0 795 781 794 0 155 9.308 2.238 113.991 1 ? 4.608e+03 2.60e+00 a 0 795 784 794 0 156 7.242 4.348 122.531 1 ? 1.747e+04 7.37e+00 a 0 1087 1075 1086 0 157 7.242 2.878 122.531 1 ? 1.750e+04 3.32e+00 a 0 1087 1078 1086 0 158 8.620 4.456 121.185 1 ? 1.869e+05 2.06e+01 a 0 0 0 0 0 159 8.620 1.933 121.185 1 ? 7.372e+04 1.44e+01 a 0 0 0 0 0 160 8.620 2.339 121.185 1 ? 7.654e+04 1.35e+01 a 0 0 0 0 0 161 8.664 4.888 123.419 1 ? 2.448e+04 6.13e+00 a 0 855 840 855 0 162 8.712 5.088 123.577 1 ? 1.989e+04 6.30e+00 a 0 883 857 882 0 164 7.534 4.006 121.348 1 ? 2.532e+04 7.94e+00 a 0 1331 1307 1330 0 165 7.534 1.895 121.348 1 ? 1.737e+04 7.78e+00 a 0 1331 1310 1330 0 166 7.507 4.629 121.488 1 ? 3.539e+04 1.45e+01 a 0 757 749 756 0 167 7.508 2.736 121.488 1 ? 7.231e+04 9.83e+00 a 0 757 751 756 0 168 8.381 1.796 122.656 1 ? 1.279e+05 7.00e+00 a 0 147 138 146 0 172 8.363 4.268 121.505 1 ? 2.024e+05 1.75e+01 a 0 2023 2011 2022 0 173 8.363 2.020 121.505 1 ? 1.810e+05 1.10e+01 a 0 2023 2014 2022 0 174 8.330 2.335 121.426 1 ? 5.684e+04 6.55e+00 a 0 1771 1760 1770 0 175 8.330 4.440 121.426 1 ? 1.279e+05 6.41e+00 a 0 0 0 0 0 176 8.330 1.901 121.426 1 ? 6.037e+04 5.92e+00 a 0 0 0 0 0 178 8.298 3.727 119.406 1 ? 2.590e+04 1.08e+01 a 0 1305 1281 1304 0 179 8.298 1.899 119.406 1 ? 1.908e+04 7.83e+00 a 0 1305 1284 1304 0 180 8.306 2.027 118.549 1 ? 1.670e+04 6.28e+00 a 0 747 736 746 0 181 8.306 2.347 118.549 1 ? 1.462e+04 5.79e+00 a 0 747 735 746 0 182 8.124 1.894 116.104 1 ? 3.101e+04 5.80e+00 a 0 1135 1114 1134 0 183 8.124 3.792 116.104 1 ? 4.248e+04 3.87e+00 a 0 1135 1111 1134 0 184 7.907 3.829 106.880 1 ? 2.512e+04 9.09e+00 a 0 809 805 808 0 185 7.907 3.556 106.880 1 ? 2.533e+04 6.65e+00 a 0 809 804 808 0 186 7.391 3.965 114.992 1 ? 2.592e+04 1.04e+01 a 0 1040 1021 1039 0 187 7.391 1.992 114.992 1 ? 1.525e+04 5.38e+00 a 0 1040 1023 1039 0 188 8.573 4.631 121.551 1 ? 1.260e+05 4.59e+00 a 0 77 62 76 0 190 7.799 4.734 113.597 1 ? 1.154e+04 4.79e+00 a 0 0 0 0 0 191 7.799 2.807 113.597 1 ? 9.454e+03 3.81e+00 a 0 0 0 0 0 193 8.223 2.171 124.958 1 ? 2.935e+04 8.20e+00 a 0 1475 1461 1474 0 194 8.223 4.240 124.958 1 ? 5.027e+04 5.16e+00 a 0 1475 1459 1474 0 195 8.264 1.815 124.121 1 ? 1.104e+05 9.08e+00 a 0 1827 1804 1826 0 196 8.237 1.959 123.232 1 ? 1.755e+05 6.30e+00 a 0 0 0 0 0 197 8.240 2.043 123.232 1 ? -2.469e+04 2.93e+00 a 0 1975 1966 1974 0 203 8.209 3.219 122.486 1 ? 2.181e+05 5.13e+00 a 0 0 0 0 0 204 8.366 4.306 122.794 1 ? 2.987e+05 1.11e+01 a 0 147 135 146 0 205 8.100 1.951 121.753 1 ? 9.473e+04 9.54e+00 a 0 698 689 697 0 206 8.100 4.293 121.753 1 ? 1.102e+05 8.26e+00 a 0 698 686 697 0 207 8.187 2.022 121.286 1 ? 1.630e+05 1.31e+01 a 0 1570 1561 1569 0 208 8.187 4.371 121.286 1 ? 1.551e+05 9.07e+00 a 0 0 0 0 0 211 8.173 4.588 117.856 1 ? 9.019e+04 9.31e+00 a 0 1528 1507 1527 0 212 8.173 3.043 117.856 1 ? 4.332e+04 6.98e+00 a 0 1528 1510 1527 0 214 8.360 4.826 115.098 1 ? 1.132e+04 5.46e+00 a 0 94 79 93 0 217 8.430 4.454 121.642 1 ? 1.501e+05 5.33e+00 a 0 0 0 0 0 218 8.430 2.295 121.642 1 ? 6.759e+04 4.21e+00 a 0 600 588 599 0 219 8.173 2.713 120.686 1 ? 2.547e+05 1.30e+01 a 0 351 346 350 0 220 8.173 4.601 120.686 1 ? 1.305e+05 1.10e+01 a 0 351 343 350 0 223 8.248 2.037 123.532 1 ? 2.738e+05 9.30e+00 a 0 445 435 444 0 224 8.248 4.358 123.532 1 ? 5.425e+05 8.85e+00 a 0 1975 1963 1974 0 225 7.850 1.594 114.579 1 ? 0.000e+00 0.00e+00 - 0 1447 1429 1446 0 226 8.798 3.089 117.053 1 ? 0.000e+00 0.00e+00 - 0 1019 1001 1018 0 227 7.828 1.861 117.172 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 228 8.110 4.587 117.482 1 ? 0.000e+00 0.00e+00 - 0 43 28 42 0 229 8.110 3.089 117.482 1 ? 0.000e+00 0.00e+00 - 0 43 31 42 0 230 8.506 2.955 118.004 1 ? 0.000e+00 0.00e+00 - 0 996 977 995 0 231 7.766 4.328 118.518 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 232 7.766 1.369 118.518 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 233 8.125 1.919 119.140 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 234 8.125 2.298 119.140 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 235 8.125 4.403 119.140 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 236 7.601 1.437 118.988 1 ? 0.000e+00 0.00e+00 - 0 1381 1363 1380 0 237 8.075 3.876 120.798 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 238 8.075 1.921 120.798 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 239 8.493 2.319 121.203 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 240 8.415 1.851 121.668 1 ? 0.000e+00 0.00e+00 - 0 386 369 385 0 241 8.573 2.380 121.551 1 ? 0.000e+00 0.00e+00 - 0 431 408 430 0 242 8.573 2.043 121.551 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 243 8.698 4.721 121.835 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 244 8.698 2.112 121.835 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 245 8.579 4.522 122.664 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 246 8.579 2.198 122.664 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 247 7.585 3.808 122.825 1 ? 0.000e+00 0.00e+00 - 0 1148 1137 1147 0 248 8.237 4.332 123.232 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 250 8.664 2.699 123.419 1 ? 0.000e+00 0.00e+00 - 0 855 843 855 0 252 7.863 2.889 123.872 1 ? 0.000e+00 0.00e+00 - 0 674 664 673 0 253 8.418 3.865 123.700 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 254 8.537 3.881 123.532 1 ? 0.000e+00 0.00e+00 - 0 1538 1533 1537 0 256 8.264 4.340 124.121 1 ? 0.000e+00 0.00e+00 - 0 1827 1801 1826 0 257 8.002 4.325 128.053 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 258 8.002 1.822 128.053 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 259 9.306 4.986 130.408 1 ? 0.000e+00 0.00e+00 - 0 893 885 892 0 260 7.962 4.392 130.126 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 261 7.962 1.831 130.126 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 262 8.660 1.727 127.431 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 263 8.660 4.016 127.431 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 264 8.306 4.267 118.549 1 ? 0.000e+00 0.00e+00 - 0 747 733 746 0 265 7.508 2.554 121.488 1 ? 0.000e+00 0.00e+00 - 0 757 752 756 0 266 7.986 0.975 118.474 1 ? 0.000e+00 0.00e+00 - 0 1109 1091 1108 0 267 8.712 1.606 123.577 1 ? 0.000e+00 0.00e+00 - 0 883 859 882 0 268 8.712 1.473 123.577 1 ? 0.000e+00 0.00e+00 - 0 883 860 882 0 269 9.308 1.655 113.991 1 ? 0.000e+00 0.00e+00 - 0 795 783 794 0 270 8.374 4.134 123.908 1 ? 0.000e+00 0.00e+00 - 0 915 895 914 0 271 8.374 1.660 123.908 1 ? 0.000e+00 0.00e+00 - 0 915 898 914 0 273 8.664 3.288 123.419 1 ? 0.000e+00 0.00e+00 - 0 855 842 855 0 274 8.335 1.331 120.384 1 ? 0.000e+00 0.00e+00 - 0 973 950 972 0 275 8.335 4.521 120.384 1 ? 0.000e+00 0.00e+00 - 0 973 947 972 0 277 7.962 4.201 122.871 1 ? 0.000e+00 0.00e+00 - 0 935 927 934 0 278 7.962 2.638 122.871 1 ? 0.000e+00 0.00e+00 - 0 935 929 934 0 279 7.962 3.222 122.871 1 ? 0.000e+00 0.00e+00 - 0 0 0 0 0 280 8.331 2.931 113.706 1 ? 0.000e+00 0.00e+00 - 0 1050 1045 1049 0 281 7.522 2.898 119.440 1 ? 0.000e+00 0.00e+00 - 0 1262 1257 1261 0 282 7.522 2.762 119.440 1 ? 0.000e+00 0.00e+00 - 0 1262 1256 1261 0