# Number of dimensions 3 #FORMAT xeasy3D_LW #INAME 1 1H #INAME 2 15N #INAME 3 13C #ASSIGN_MODE 1 SSP 1 11.113 134.848 179.658 1 ? 4.160e+04 7.36e+00 a 0 0 0 0 #LW 0.039 0.538 0.859 #ID 2 2 8.736 131.503 175.125 1 ? 1.094e+05 1.57e+01 a 0 0 0 0 #LW 0.043 0.400 0.213 #ID 3 3 8.950 131.373 176.256 1 ? 9.592e+04 1.78e+01 a 0 0 0 0 #LW 0.045 0.349 0.215 #ID 4 4 10.231 129.032 179.040 1 ? 5.008e+04 9.96e+00 a 0 0 0 0 #LW 0.041 0.389 0.892 #ID 5 5 8.543 129.006 174.660 1 ? 1.249e+05 1.47e+01 a 0 0 0 0 #LW 0.049 0.349 0.217 #ID 6 6 9.170 128.959 174.329 1 ? 1.123e+05 1.43e+01 a 0 0 0 0 #LW 0.046 0.377 0.214 #ID 7 7 9.118 128.930 172.537 1 ? 9.239e+04 1.90e+01 a 0 0 0 0 #LW 0.047 0.389 0.210 #ID 8 8 7.454 128.842 176.296 1 ? 2.623e+05 1.44e+01 a 0 0 0 0 #LW 0.035 0.353 0.209 #ID 9 9 10.599 128.763 178.886 1 ? 4.915e+04 8.97e+00 a 0 0 0 0 #LW 0.046 0.473 0.714 #ID 10 10 9.393 128.817 176.967 1 ? 1.013e+05 2.30e+01 a 0 0 0 0 #LW 0.048 0.349 0.215 #ID 11 11 8.142 128.307 173.086 1 ? 1.490e+05 1.39e+01 a 0 0 0 0 #LW 0.048 0.353 0.214 #ID 12 12 9.039 128.218 173.713 1 ? 1.170e+05 1.47e+01 a 0 0 0 0 #LW 0.049 0.360 0.219 #ID 13 13 8.911 128.184 174.428 1 ? 1.076e+05 1.76e+01 a 0 0 0 0 #LW 0.046 0.381 0.211 #ID 14 14 10.124 128.080 176.661 1 ? 9.471e+04 1.95e+01 a 0 0 0 0 #LW 0.045 0.389 0.225 #ID 15 15 9.369 127.665 173.555 1 ? 1.385e+05 2.47e+01 a 0 0 0 0 #LW 0.051 0.374 0.216 #ID 16 16 8.636 127.461 176.956 1 ? 9.514e+04 1.93e+01 a 0 0 0 0 #LW 0.049 0.349 0.214 #ID 17 17 7.418 127.200 175.271 1 ? 1.077e+05 1.62e+01 a 0 0 0 0 #LW 0.041 0.349 0.219 #ID 18 18 8.956 126.432 174.998 1 ? 1.204e+05 2.02e+01 a 0 0 0 0 #LW 0.048 0.356 0.212 #ID 19 19 9.180 126.010 174.611 1 ? 1.077e+05 2.28e+01 a 0 0 0 0 #LW 0.049 0.374 0.220 #ID 20 20 8.751 125.835 174.269 1 ? 1.250e+05 2.62e+01 a 0 0 0 0 #LW 0.049 0.374 0.217 #ID 21 21 7.593 125.824 176.259 1 ? 9.554e+04 1.60e+01 a 0 0 0 0 #LW 0.045 0.374 0.210 #ID 22 22 9.694 125.745 174.401 1 ? 1.599e+05 1.91e+01 a 0 0 0 0 #LW 0.047 0.360 0.213 #ID 23 23 9.586 125.571 175.073 1 ? 1.433e+05 1.71e+01 a 0 0 0 0 #LW 0.046 0.377 0.218 #ID 24 24 9.887 125.521 171.918 1 ? 1.422e+05 1.89e+01 a 0 0 0 0 #LW 0.048 0.366 0.218 #ID 25 25 8.412 125.335 176.418 1 ? 2.767e+05 1.37e+01 a 0 0 0 0 #LW 0.034 0.370 0.205 #ID 26 26 7.998 124.718 173.086 1 ? 1.836e+05 2.67e+01 a 0 0 0 0 #LW 0.044 0.360 0.215 #ID 27 27 8.344 124.332 178.513 1 ? 1.381e+05 1.63e+01 a 0 0 0 0 #LW 0.040 0.374 0.224 #ID 28 28 8.513 124.266 175.571 1 ? 1.384e+05 1.49e+01 a 0 0 0 0 #LW 0.041 0.401 0.216 #ID 29 29 8.402 124.298 174.339 1 ? 2.587e+05 1.40e+01 a 0 0 0 0 #LW 0.037 0.381 0.210 #ID 30 30 8.417 123.876 173.799 1 ? 1.299e+05 1.78e+01 a 0 0 0 0 #LW 0.049 0.297 0.214 #ID 31 31 6.591 123.849 176.011 1 ? 1.095e+05 2.00e+01 a 0 0 0 0 #LW 0.042 0.356 0.236 #ID 32 32 9.337 123.760 175.348 1 ? 1.246e+05 2.63e+01 a 0 0 0 0 #LW 0.049 0.377 0.220 #ID 33 33 8.788 123.645 175.200 1 ? 1.077e+05 2.49e+01 a 0 0 0 0 #LW 0.049 0.308 0.220 #ID 34 34 9.235 123.371 174.668 1 ? 1.274e+05 1.75e+01 a 0 0 0 0 #LW 0.042 0.351 0.220 #ID 35 35 7.755 123.337 176.353 1 ? 1.387e+05 2.07e+01 a 0 0 0 0 #LW 0.044 0.349 0.212 #ID 36 36 8.423 122.954 179.961 1 ? 1.478e+05 1.52e+01 a 0 0 0 0 #LW 0.041 0.366 0.214 #ID 37 37 7.733 122.925 174.464 1 ? 1.430e+05 1.96e+01 a 0 0 0 0 #LW 0.040 0.353 0.212 #ID 38 38 8.347 122.550 174.709 1 ? 2.867e+05 1.41e+01 a 0 0 0 0 #LW 0.039 0.360 0.214 #ID 39 39 8.510 122.360 177.185 1 ? 2.919e+05 2.13e+01 a 0 0 0 0 #LW 0.037 0.325 0.206 #ID 40 40 8.774 122.289 173.262 1 ? 7.161e+04 2.42e+01 a 0 0 0 0 #LW 0.043 0.374 0.214 #ID 41 41 8.643 122.148 175.625 1 ? 1.504e+05 2.87e+01 a 0 0 0 0 #LW 0.043 0.349 0.214 #ID 42 42 8.189 122.063 179.148 1 ? 1.563e+05 2.03e+01 a 0 0 0 0 #LW 0.042 0.342 0.216 #ID 43 43 6.611 122.061 175.700 1 ? 6.051e+04 1.80e+01 a 0 0 0 0 #LW 0.048 0.362 0.225 #ID 44 44 7.320 121.841 176.329 1 ? 1.576e+05 2.24e+01 a 0 0 0 0 #LW 0.040 0.308 0.214 #ID 45 45 8.024 121.798 177.400 1 ? 1.386e+05 1.22e+01 a 0 0 0 0 #LW 0.043 0.341 0.215 #ID 46 46 7.833 121.806 173.483 1 ? 1.071e+05 1.70e+01 a 0 0 0 0 #LW 0.042 0.349 0.222 #ID 47 47 8.084 121.610 179.812 1 ? 1.424e+05 2.43e+01 a 0 0 0 0 #LW 0.040 0.342 0.215 #ID 48 48 7.473 121.558 174.705 1 ? 1.773e+05 2.33e+01 a 0 0 0 0 #LW 0.040 0.325 0.219 #ID 49 49 7.916 121.366 175.547 1 ? 1.536e+05 3.12e+01 a 0 0 0 0 #LW 0.042 0.342 0.235 #ID 50 50 8.475 121.232 176.072 1 ? 1.631e+05 1.68e+01 a 0 0 0 0 #LW 0.049 0.373 0.221 #ID 51 51 8.306 121.097 178.819 1 ? 1.623e+05 1.67e+01 a 0 0 0 0 #LW 0.042 0.349 0.220 #ID 52 52 7.925 121.099 176.699 1 ? 9.259e+04 1.09e+01 a 0 0 0 0 #LW 0.044 0.356 0.225 #ID 53 53 8.194 121.058 176.181 1 ? 2.558e+05 8.13e+00 a 0 0 0 0 #LW 0.040 0.374 0.208 #ID 54 54 8.194 121.058 177.126 1 ? 2.373e+05 7.04e+00 a 0 0 0 0 #LW 0.040 0.374 0.417 #ID 54 55 7.876 121.049 180.209 1 ? 1.124e+05 2.64e+01 a 0 0 0 0 #LW 0.040 0.322 0.221 #ID 55 56 7.595 121.068 178.775 1 ? 1.398e+05 1.94e+01 a 0 0 0 0 #LW 0.040 0.303 0.220 #ID 56 57 7.000 121.061 170.403 1 ? 1.012e+05 1.44e+01 a 0 0 0 0 #LW 0.045 0.329 0.221 #ID 57 58 7.773 120.970 173.438 1 ? 1.143e+05 1.85e+01 a 0 0 0 0 #LW 0.042 0.363 0.219 #ID 58 59 9.116 120.836 174.254 1 ? 5.632e+04 1.41e+01 a 0 0 0 0 #LW 0.054 0.322 0.207 #ID 59 60 8.954 120.688 174.709 1 ? 1.196e+05 2.01e+01 a 0 0 0 0 #LW 0.049 0.366 0.218 #ID 60 61 7.960 120.677 179.133 1 ? 1.567e+05 2.73e+01 a 0 0 0 0 #LW 0.041 0.374 0.217 #ID 61 62 8.365 120.594 181.327 1 ? 1.324e+05 1.82e+01 a 0 0 0 0 #LW 0.041 0.353 0.219 #ID 62 63 8.790 120.370 177.179 1 ? 1.424e+05 2.71e+01 a 0 0 0 0 #LW 0.040 0.366 0.216 #ID 63 64 7.593 120.056 177.643 1 ? 1.011e+05 1.37e+01 a 0 0 0 0 #LW 0.041 0.324 0.210 #ID 64 65 7.352 119.984 176.360 1 ? 1.642e+05 1.96e+01 a 0 0 0 0 #LW 0.045 0.385 0.218 #ID 65 66 9.444 119.851 179.193 1 ? 6.486e+04 2.02e+01 a 0 0 0 0 #LW 0.040 0.376 0.232 #ID 66 67 8.068 119.789 179.955 1 ? 1.616e+05 2.48e+01 a 0 0 0 0 #LW 0.041 0.322 0.217 #ID 67 68 7.264 119.744 178.822 1 ? 1.326e+05 2.46e+01 a 0 0 0 0 #LW 0.042 0.349 0.213 #ID 68 69 7.750 119.453 177.877 1 ? 1.516e+05 1.86e+01 a 0 0 0 0 #LW 0.040 0.359 0.217 #ID 69 70 8.527 119.354 175.265 1 ? 1.302e+05 1.70e+01 a 0 0 0 0 #LW 0.043 0.360 0.221 #ID 70 71 9.276 119.158 177.988 1 ? 1.057e+05 1.63e+01 a 0 0 0 0 #LW 0.046 0.377 0.223 #ID 71 72 7.860 118.811 178.751 1 ? 1.574e+05 1.27e+01 a 0 0 0 0 #LW 0.043 0.374 0.220 #ID 72 73 7.860 118.811 179.319 1 ? 9.059e+04 7.93e+00 a 0 0 0 0 #LW 0.043 0.374 0.215 #ID 72 74 7.927 118.798 176.422 1 ? 8.211e+04 2.06e+01 a 0 0 0 0 #LW 0.042 0.345 0.222 #ID 73 75 7.429 118.795 176.900 1 ? 1.222e+05 2.04e+01 a 0 0 0 0 #LW 0.039 0.342 0.218 #ID 74 76 8.485 118.680 175.516 1 ? 1.091e+05 1.35e+01 a 0 0 0 0 #LW 0.048 0.414 0.229 #ID 75 77 8.308 118.635 179.431 1 ? 1.539e+05 1.21e+01 a 0 0 0 0 #LW 0.043 0.375 0.217 #ID 76 78 6.460 118.631 177.105 1 ? 1.096e+05 1.63e+01 a 0 0 0 0 #LW 0.039 0.360 0.210 #ID 77 79 8.994 118.279 174.594 1 ? 1.568e+05 1.79e+01 a 0 0 0 0 #LW 0.040 0.360 0.228 #ID 78 80 8.331 118.272 175.575 1 ? 1.589e+05 1.03e+01 a 0 0 0 0 #LW 0.041 0.324 0.217 #ID 79 81 7.692 118.014 177.996 1 ? 1.083e+05 1.52e+01 a 0 0 0 0 #LW 0.044 0.327 0.215 #ID 80 82 8.438 117.718 177.821 1 ? 1.490e+05 1.31e+01 a 0 0 0 0 #LW 0.037 0.326 0.218 #ID 81 83 7.881 117.676 174.507 1 ? 1.389e+05 1.69e+01 a 0 0 0 0 #LW 0.041 0.360 0.224 #ID 82 84 7.275 117.352 178.683 1 ? 1.532e+05 1.14e+01 a 0 0 0 0 #LW 0.043 0.373 0.218 #ID 83 85 7.275 117.352 172.900 1 ? 3.061e+04 5.01e+00 a 0 0 0 0 #LW 0.043 0.373 0.228 #ID 83 86 8.475 117.290 173.214 1 ? 1.239e+05 1.12e+01 a 0 0 0 0 #LW 0.048 0.362 0.215 #ID 84 87 7.735 117.283 175.576 1 ? 1.098e+05 1.25e+01 a 0 0 0 0 #LW 0.041 0.356 0.223 #ID 85 88 8.181 117.088 177.624 1 ? 1.460e+05 1.20e+01 a 0 0 0 0 #LW 0.042 0.385 0.221 #ID 86 89 6.624 116.669 174.757 1 ? 6.175e+04 9.41e+00 a 0 0 0 0 #LW 0.045 0.369 0.235 #ID 87 90 7.515 116.621 180.353 1 ? 1.220e+05 1.27e+01 a 0 0 0 0 #LW 0.039 0.366 0.219 #ID 88 91 8.139 116.533 179.619 1 ? 1.407e+05 1.24e+01 a 0 0 0 0 #LW 0.041 0.353 0.216 #ID 89 92 7.791 116.320 177.091 1 ? 1.367e+05 1.04e+01 a 0 0 0 0 #LW 0.042 0.391 0.218 #ID 90 93 7.703 115.930 173.131 1 ? 1.050e+05 1.56e+01 a 0 0 0 0 #LW 0.043 0.324 0.217 #ID 91 94 8.818 115.429 175.803 1 ? 1.396e+05 1.29e+01 a 0 0 0 0 #LW 0.042 0.303 0.226 #ID 92 95 8.036 115.287 176.112 1 ? 9.227e+04 1.20e+01 a 0 0 0 0 #LW 0.050 0.377 0.220 #ID 93 96 8.686 115.211 178.780 1 ? 1.537e+05 1.13e+01 a 0 0 0 0 #LW 0.040 0.338 0.216 #ID 94 97 7.609 115.149 176.985 1 ? 9.224e+04 1.71e+01 a 0 0 0 0 #LW 0.045 0.020 0.220 #ID 95 98 8.609 115.124 175.722 1 ? 7.333e+04 2.19e+01 a 0 0 0 0 #LW 0.047 0.325 0.221 #ID 96 99 6.908 115.070 179.832 1 ? 1.058e+05 1.07e+01 a 0 0 0 0 #LW 0.040 0.381 0.219 #ID 97 100 8.847 114.677 176.747 1 ? 1.239e+05 1.41e+01 a 0 0 0 0 #LW 0.042 0.318 0.220 #ID 98 101 8.274 114.675 177.955 1 ? 2.194e+05 9.12e+00 a 0 0 0 0 #LW 0.035 0.339 0.210 #ID 99 102 7.741 114.652 174.854 1 ? 1.516e+05 1.22e+01 a 0 0 0 0 #LW 0.042 0.315 0.212 #ID 100 103 8.658 114.427 179.863 1 ? 1.467e+05 1.42e+01 a 0 0 0 0 #LW 0.040 0.348 0.212 #ID 101 104 7.221 114.363 177.729 1 ? 1.371e+05 1.18e+01 a 0 0 0 0 #LW 0.043 0.348 0.217 #ID 102 105 7.708 113.433 178.290 1 ? 2.510e+04 3.69e+00 a 0 0 0 0 #LW 0.034 0.826 0.219 #ID 103 106 6.676 113.440 178.275 1 ? 2.204e+04 2.60e+00 a 0 0 0 0 #LW 0.039 1.500 0.198 #ID 104 107 7.462 112.575 180.624 1 ? 2.121e+04 3.04e+00 a 0 0 0 0 #LW 0.032 0.771 0.219 #ID 105 108 6.812 112.766 174.875 1 ? 2.936e+04 4.87e+00 a 0 0 0 0 #LW 0.500 0.517 0.240 #ID 106 109 7.592 112.177 180.352 1 ? 6.908e+03 3.39e+00 a 0 0 0 0 #LW 0.021 0.465 0.244 #ID 107 110 6.840 112.189 180.453 1 ? 4.737e+04 6.59e+00 a 0 0 0 0 #LW 0.034 0.833 0.411 #ID 108 111 7.926 112.150 177.968 1 ? 1.272e+05 1.15e+01 a 0 0 0 0 #LW 0.043 0.365 0.217 #ID 109 112 7.408 111.917 180.676 1 ? 2.211e+04 3.51e+00 a 0 0 0 0 #LW 0.029 0.760 0.216 #ID 110 113 6.819 111.904 180.651 1 ? 1.925e+04 3.94e+00 a 0 0 0 0 #LW 0.026 0.905 0.181 #ID 111 114 7.608 111.884 180.346 1 ? 1.527e+04 6.36e+00 a 0 0 0 0 #LW 0.028 0.322 0.221 #ID 112 115 6.985 111.724 175.911 1 ? 2.927e+04 4.62e+00 a 0 0 0 0 #LW 0.047 0.985 0.226 #ID 113 116 7.214 111.590 170.990 1 ? 4.609e+03 1.91e+00 a 0 0 0 0 #LW 0.086 0.444 0.205 #ID 114 117 8.051 111.580 179.135 1 ? 1.026e+05 1.29e+01 a 0 0 0 0 #LW 0.040 0.291 0.217 #ID 115 118 7.434 110.902 179.549 1 ? 2.455e+04 4.48e+00 a 0 0 0 0 #LW 0.029 0.722 0.227 #ID 116 119 6.849 110.914 179.528 1 ? 2.492e+04 3.96e+00 a 0 0 0 0 #LW 0.035 0.920 0.220 #ID 117 120 8.691 110.962 177.487 1 ? 9.867e+04 6.70e+00 a 0 0 0 0 #LW 0.047 0.433 0.217 #ID 118 121 8.092 110.926 178.026 1 ? 6.857e+04 9.02e+00 a 0 0 0 0 #LW 0.045 0.418 0.223 #ID 119 122 7.384 110.043 175.461 1 ? 2.749e+04 5.17e+00 a 0 0 0 0 #LW 0.033 0.809 0.216 #ID 120 123 6.547 110.018 175.426 1 ? 2.251e+04 3.52e+00 a 0 0 0 0 #LW 0.032 0.838 0.190 #ID 121 124 7.341 104.628 173.011 1 ? 1.028e+05 1.40e+01 a 0 0 0 0 #LW 0.041 0.043 0.212 #ID 122 125 8.902 104.331 176.183 1 ? 5.680e+04 5.28e+00 a 0 0 0 0 #LW 0.053 0.461 0.220 #ID 123