Mercurial > repos > marcel > caddsuite_linux_x86_64
diff CADDSuite-1.0/data/OpenBabel/mmffang.par @ 14:55c32b55c2c2
Uploaded Version 1.1
| author | marcel |
|---|---|
| date | Thu, 12 Jan 2012 11:00:43 -0500 |
| parents | |
| children |
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--- /dev/null Thu Jan 01 00:00:00 1970 +0000 +++ b/CADDSuite-1.0/data/OpenBabel/mmffang.par Thu Jan 12 11:00:43 2012 -0500 @@ -0,0 +1,2354 @@ +* +* Copyright (c) Merck and Co., Inc., 1994 +* All Rights Reserved +* +* MMFF ANGLE PARAMETERS- Rev: 26-Oct-94 Source: MMFF94 +* C94 = CORE MMFF94 parameter - obtained from ab initio data +* X94 = EXTD MMFF94 parameter - fit to additional ab initio data +* E94 = theta0 from fit to X-ray data, ka from empirical rule +* #E94 = theta0 and ka both from empirical rules +* +* types ka theta0 Comment/origin +0 0 1 0 0.000 108.900 0:*-1-* MMFF94 DEF +0 1 1 1 0.851 109.608 C94 +0 1 1 2 0.736 109.445 C94 +0 1 1 3 0.777 107.517 C94 +0 1 1 4 1.006 110.265 E94 +0 1 1 5 0.636 110.549 C94 +0 1 1 6 0.992 108.133 C94 +0 1 1 8 0.777 108.290 C94 +0 1 1 9 1.136 108.194 E94 +0 1 1 10 1.050 109.960 C94 +0 1 1 11 1.225 108.313 C94 +0 1 1 12 1.056 108.679 C94 +0 1 1 13 1.078 106.820 E94 +0 1 1 14 0.980 109.945 E94 +0 1 1 15 0.743 107.397 C94 +0 1 1 17 1.089 108.578 E94 +0 1 1 18 1.093 109.315 E94 +0 1 1 19 0.755 115.436 E94 +0 1 1 20 1.021 108.659 E94 +0 1 1 22 1.001 110.125 E94 +0 1 1 25 0.803 112.356 X94 +0 1 1 26 0.833 109.879 E94 +0 1 1 34 1.179 106.493 C94 +0 1 1 37 0.756 108.617 C94 +0 1 1 39 0.927 109.170 C94 +0 1 1 40 1.130 108.678 E94 +0 1 1 41 0.330 98.422 C94 +0 1 1 43 1.135 108.019 E94 +0 1 1 45 1.197 105.028 E94 +0 1 1 54 1.173 106.424 E94 +0 1 1 55 1.150 107.604 E94 +0 1 1 56 1.199 110.371 C94 +0 1 1 57 1.012 109.900 E94 +0 1 1 58 1.179 106.327 E94 +0 1 1 61 1.125 109.311 E94 +0 1 1 63 1.006 110.058 E94 +0 1 1 64 0.988 111.064 E94 +0 1 1 67 1.216 104.557 E94 +0 1 1 68 1.018 107.195 C94 +0 1 1 73 1.160 104.658 E94 +0 1 1 78 1.012 109.850 E94 +0 1 1 80 0.947 113.327 E94 +0 1 1 81 1.108 109.837 E94 +0 2 1 2 1.113 111.453 C94 +0 2 1 3 0.667 104.829 C94 +0 2 1 4 1.022 109.873 E94 +0 2 1 5 0.632 110.292 C94 +0 2 1 6 1.074 108.699 C94 +0 2 1 8 0.884 111.553 C94 +0 2 1 9 1.118 109.577 E94 +0 2 1 10 1.160 107.963 E94 +0 2 1 11 1.192 110.419 E94 +0 2 1 12 1.070 109.410 E94 +0 2 1 15 1.078 109.560 E94 +0 2 1 17 1.077 109.434 E94 +0 2 1 18 1.188 105.110 E94 +0 2 1 20 1.053 107.448 E94 +0 2 1 22 0.942 114.020 E94 +0 2 1 25 0.893 106.815 E94 +0 2 1 26 1.029 99.065 E94 +0 2 1 34 1.066 111.817 E94 +0 2 1 37 0.985 111.446 E94 +0 2 1 39 1.124 109.513 E94 +0 2 1 40 1.149 108.270 E94 +0 2 1 45 1.232 103.978 E94 +0 2 1 63 0.935 114.692 E94 +0 2 1 67 1.224 104.687 E94 +0 3 1 3 0.974 111.746 E94 +0 3 1 4 1.019 109.850 E94 +0 3 1 5 0.650 108.385 C94 +0 3 1 6 0.528 104.112 C94 +0 3 1 8 1.197 105.837 E94 +0 3 1 9 1.201 105.535 E94 +0 3 1 10 0.634 102.655 C94 +0 3 1 11 1.189 110.328 E94 +0 3 1 12 1.136 106.064 E94 +0 3 1 13 1.147 103.645 E94 +0 3 1 14 1.048 106.404 E94 +0 3 1 15 1.125 107.192 E94 +0 3 1 17 1.092 108.602 E94 +0 3 1 18 1.120 108.119 E94 +0 3 1 20 0.969 111.830 E94 +0 3 1 22 0.999 110.522 E94 +0 3 1 26 0.742 116.555 E94 +0 3 1 34 1.141 107.871 E94 +0 3 1 37 1.011 109.833 E94 +0 3 1 39 1.136 108.751 E94 +0 3 1 40 1.174 106.941 E94 +0 3 1 41 1.033 108.216 E94 +0 3 1 45 1.221 104.281 E94 +0 3 1 63 1.069 107.077 E94 +0 3 1 64 1.028 109.186 E94 +0 3 1 81 1.167 107.327 E94 +0 4 1 4 0.954 114.186 E94 +0 4 1 5 0.615 111.417 X94 +0 4 1 6 1.273 109.977 E94 +0 4 1 8 1.099 111.063 E94 +0 4 1 9 1.187 106.750 E94 +0 4 1 10 1.117 110.488 E94 +0 4 1 13 1.021 110.047 E94 +0 4 1 15 1.028 112.432 E94 +0 4 1 18 1.187 105.351 E94 +0 4 1 22 1.174 102.556 E94 +0 4 1 26 0.853 108.999 E94 +0 4 1 34 1.148 108.160 E94 +0 4 1 37 0.993 111.424 E94 +0 5 1 5 0.516 108.836 C94 +0 5 1 6 0.781 108.577 C94 +0 5 1 8 0.653 110.297 C94 +0 5 1 9 0.733 109.894 C94 +0 5 1 10 0.740 107.646 C94 +0 5 1 11 0.875 107.897 C94 +0 5 1 12 0.698 108.162 C94 +0 5 1 13 0.613 106.049 E94 +0 5 1 14 0.508 113.019 E94 +0 5 1 15 0.576 109.609 C94 +0 5 1 17 0.634 107.944 X94 +0 5 1 18 0.663 106.855 X94 +0 5 1 19 0.450 113.195 X94 +0 5 1 20 0.706 111.000 C94 +0 5 1 22 0.618 110.380 E94 +0 5 1 25 0.487 109.486 X94 +0 5 1 26 0.466 111.172 X94 +0 5 1 34 0.872 106.224 C94 +0 5 1 35 0.644 125.663 X94 +0 5 1 37 0.627 109.491 C94 +0 5 1 39 0.811 106.299 C94 +0 5 1 40 0.719 109.870 C94 +0 5 1 41 0.525 108.904 C94 +0 5 1 43 0.692 109.083 X94 +0 5 1 45 0.741 105.197 X94 +0 5 1 46 0.719 106.735 X94 +0 5 1 54 0.874 106.973 C94 +0 5 1 55 0.861 108.507 C94 +0 5 1 56 0.814 108.223 C94 +0 5 1 57 0.626 110.420 E94 +0 5 1 58 0.750 105.481 E94 +0 5 1 61 0.710 109.227 X94 +0 5 1 62 0.655 113.035 X94 +0 5 1 63 0.621 110.467 E94 +0 5 1 64 0.622 110.457 E94 +0 5 1 67 0.732 106.474 E94 +0 5 1 68 0.748 103.817 C94 +0 5 1 72 0.547 116.576 X94 +0 5 1 73 0.633 107.153 X94 +0 5 1 78 0.640 109.078 E94 +0 5 1 80 0.684 105.144 E94 +0 5 1 81 0.721 107.870 E94 +0 6 1 6 1.156 111.368 C94 +0 6 1 8 1.333 112.223 E94 +0 6 1 9 1.224 116.950 E94 +0 6 1 10 1.432 108.568 E94 +0 6 1 11 1.593 106.900 E94 +0 6 1 15 1.273 112.012 E94 +0 6 1 17 1.348 108.655 E94 +0 6 1 19 0.906 117.214 E94 +0 6 1 20 1.293 108.202 E94 +0 6 1 22 1.287 108.913 E94 +0 6 1 25 1.171 103.598 E94 +0 6 1 26 0.888 118.433 E94 +0 6 1 34 1.257 114.975 E94 +0 6 1 37 0.878 107.978 C94 +0 6 1 39 1.485 106.464 E94 +0 6 1 40 1.371 110.779 E94 +0 6 1 41 1.333 106.467 E94 +0 6 1 45 1.523 104.438 E94 +0 6 1 57 1.308 108.467 E94 +0 6 1 63 1.351 106.535 E94 +0 6 1 64 1.238 111.308 E94 +0 8 1 8 1.203 110.856 E94 +0 8 1 9 1.133 114.080 E94 +0 8 1 10 1.258 108.683 E94 +0 8 1 12 1.217 107.251 E94 +0 8 1 15 1.120 112.356 E94 +0 8 1 20 1.116 109.353 E94 +0 8 1 25 1.143 98.698 E94 +0 8 1 34 1.138 113.412 E94 +0 8 1 37 1.090 110.992 E94 +0 8 1 39 1.364 104.193 E94 +0 8 1 40 0.964 123.962 E94 +0 8 1 41 1.234 103.868 E94 +0 8 1 43 1.137 113.596 E94 +0 8 1 45 1.583 96.139 E94 +0 8 1 57 1.038 114.266 E94 +0 8 1 63 1.104 110.598 E94 +0 8 1 64 1.156 108.127 E94 +0 9 1 10 1.209 110.720 E94 +0 9 1 12 1.173 109.152 E94 +0 9 1 15 1.024 117.465 E94 +0 9 1 25 1.060 102.432 E94 +0 9 1 37 1.077 111.565 E94 +0 9 1 40 1.084 116.728 E94 +0 9 1 80 1.163 107.509 E94 +0 10 1 10 1.191 111.995 E94 +0 10 1 15 1.161 110.502 E94 +0 10 1 17 1.269 105.509 E94 +0 10 1 20 1.220 104.838 E94 +0 10 1 22 1.132 109.262 E94 +0 10 1 25 1.015 104.822 E94 +0 10 1 37 1.107 110.423 E94 +0 10 1 40 1.264 108.536 E94 +0 10 1 41 1.087 110.961 E94 +0 10 1 57 1.268 103.622 E94 +0 11 1 11 1.638 106.081 C94 +0 11 1 15 1.254 109.517 E94 +0 11 1 20 1.243 107.637 E94 +0 11 1 25 1.244 97.532 E94 +0 11 1 34 1.338 108.669 E94 +0 11 1 35 1.556 110.367 E94 +0 11 1 37 1.151 112.278 E94 +0 11 1 41 1.301 105.053 E94 +0 11 1 45 1.550 100.991 E94 +0 11 1 73 1.303 106.569 E94 +0 11 1 75 0.884 114.378 E94 +0 12 1 12 1.096 110.422 C94 +0 12 1 15 1.146 111.064 E94 +0 12 1 18 1.299 104.827 E94 +0 12 1 19 0.932 108.971 E94 +0 12 1 20 1.081 108.605 E94 +0 12 1 22 1.097 108.028 E94 +0 12 1 25 0.989 106.118 E94 +0 12 1 37 1.076 109.030 E94 +0 12 1 39 1.150 110.359 E94 +0 12 1 45 1.353 101.430 E94 +0 12 1 63 1.071 109.474 E94 +0 12 1 64 1.093 108.338 E94 +0 13 1 13 1.093 111.645 E94 +0 13 1 20 1.084 106.534 E94 +0 13 1 22 1.068 107.469 E94 +0 13 1 45 1.305 101.383 E94 +0 14 1 20 1.021 107.718 E94 +0 15 1 15 1.147 111.896 E94 +0 15 1 25 1.059 103.308 E94 +0 15 1 34 1.222 107.318 E94 +0 15 1 37 1.051 110.959 E94 +0 15 1 40 1.149 111.005 E94 +0 15 1 41 1.263 100.981 E94 +0 15 1 63 1.060 110.596 E94 +0 15 1 64 1.059 110.703 E94 +0 15 1 73 1.289 105.029 E94 +0 17 1 37 1.065 110.049 E94 +0 18 1 20 1.121 107.960 E94 +0 18 1 22 1.283 101.125 E94 +0 18 1 37 1.203 104.390 E94 +0 18 1 45 1.287 105.273 E94 +0 18 1 64 1.093 109.683 E94 +0 19 1 54 0.772 119.506 E94 +0 20 1 20 1.229 99.084 E94 +0 20 1 37 1.052 107.428 E94 +0 20 1 45 1.169 106.335 E94 +0 22 1 22 0.990 111.226 E94 +0 22 1 25 0.885 107.293 E94 +0 22 1 34 1.045 112.940 E94 +0 22 1 37 1.037 108.586 E94 +0 22 1 45 1.182 106.181 E94 +0 25 1 25 0.551 127.138 E94 +0 25 1 34 0.779 119.271 E94 +0 25 1 37 0.784 113.945 E94 +0 25 1 40 1.062 102.417 E94 +0 25 1 58 0.916 110.234 E94 +0 26 1 26 0.625 118.700 E94 +0 34 1 34 1.216 109.167 E94 +0 34 1 37 1.075 111.275 E94 +0 34 1 41 1.048 112.238 E94 +0 34 1 63 1.077 111.412 E94 +0 34 1 73 1.142 110.240 E94 +0 37 1 37 0.986 111.315 E94 +0 37 1 40 1.129 109.188 E94 +0 37 1 43 1.074 111.478 E94 +0 37 1 45 1.259 102.800 E94 +0 37 1 57 0.981 112.047 E94 +0 37 1 64 1.175 102.239 E94 +0 37 1 68 1.100 109.983 E94 +0 37 1 78 1.005 110.638 E94 +0 37 1 81 1.176 107.040 E94 +0 39 1 39 1.260 108.547 E94 +0 40 1 40 1.182 112.005 E94 +0 40 1 55 1.322 105.786 E94 +0 40 1 63 1.032 114.505 E94 +0 40 1 64 1.000 116.376 E94 +0 41 1 41 1.082 105.400 E94 +0 41 1 63 1.061 107.112 E94 +0 41 1 81 1.093 110.553 E94 +0 45 1 45 1.391 102.088 E94 +0 0 2 0 0.000 119.400 0:*-2-* MMFF94 DEF +1 0 2 0 0.000 118.200 0:*-2-* MMFF94 DEF +2 0 2 0 0.000 120.800 2::*-2-* MMFF94 DEF +3 0 2 0 0.000 62.600 3::*-2-* MMFF94 DEF +6 0 2 0 0.000 60.500 6:*-2-* MMFF94 DEF +0 1 2 1 0.752 118.043 C94 +0 1 2 2 0.672 122.141 C94 +1 1 2 2 0.684 116.929 C94 +1 1 2 3 0.698 116.104 C94 +0 1 2 4 0.828 125.045 E94 +1 1 2 4 0.846 121.613 E94 +0 1 2 5 0.446 120.108 C94 +0 1 2 6 1.160 115.518 E94 +0 1 2 10 1.015 116.707 E94 +0 1 2 12 0.983 115.343 E94 +0 1 2 13 0.964 115.395 E94 +0 1 2 15 0.939 119.465 E94 +0 1 2 17 0.883 121.868 E94 +0 1 2 18 0.961 117.918 E94 +0 1 2 20 0.880 118.310 E94 +0 1 2 22 0.873 119.114 E94 +0 1 2 30 0.826 124.605 E94 +1 1 2 37 0.721 116.064 C94 +0 1 2 40 0.982 118.515 E94 +0 1 2 45 1.121 109.921 E94 +0 1 2 56 1.006 117.192 E94 +1 1 2 63 0.768 127.945 E94 +1 1 2 64 0.966 113.884 E94 +1 1 2 67 1.115 110.185 E94 +1 2 2 2 0.747 121.550 C94 +2 2 2 2 0.796 126.284 E94 +6 2 2 2 0.173 60.549 E94 +1 2 2 3 0.545 111.297 C94 +2 2 2 3 0.893 118.456 E94 +5 2 2 3 0.184 59.145 E94 +1 2 2 4 0.902 121.053 E94 +2 2 2 4 0.889 119.794 E94 +0 2 2 5 0.535 121.004 C94 +1 2 2 5 0.463 118.442 C94 +0 2 2 6 1.117 121.267 C94 +1 2 2 6 1.204 114.538 E94 +1 2 2 9 0.960 123.536 E94 +2 2 2 9 1.045 116.273 E94 +0 2 2 10 1.003 120.828 E94 +1 2 2 10 1.026 117.324 E94 +0 2 2 11 1.089 119.100 X94 +1 2 2 11 1.090 116.828 E94 +0 2 2 12 0.931 120.132 X94 +1 2 2 12 0.957 117.526 E94 +0 2 2 13 0.867 122.717 E94 +0 2 2 14 0.818 122.584 E94 +1 2 2 14 0.819 122.344 E94 +0 2 2 15 0.931 121.553 E94 +1 2 2 15 0.949 119.466 E94 +0 2 2 17 0.977 117.167 E94 +0 2 2 18 1.044 114.561 E94 +0 2 2 19 0.668 124.721 E94 +0 2 2 20 0.931 117.784 E94 +0 2 2 22 0.809 126.820 E94 +3 2 2 22 0.149 66.165 E94 +0 2 2 25 0.700 123.830 E94 +0 2 2 34 1.066 116.151 E94 +0 2 2 35 0.911 137.103 X94 +1 2 2 37 0.598 117.508 C94 +2 2 2 37 0.817 124.229 E94 +1 2 2 39 0.976 122.360 E94 +0 2 2 40 0.773 126.830 C94 +1 2 2 40 0.976 120.132 E94 +0 2 2 41 0.432 110.442 C94 +0 2 2 43 1.144 111.808 E94 +0 2 2 45 1.194 109.231 X94 +1 2 2 45 1.062 113.984 E94 +0 2 2 46 1.005 121.534 E94 +0 2 2 55 0.995 121.154 E94 +0 2 2 56 1.234 108.879 E94 +0 2 2 62 0.808 135.269 X94 +1 2 2 63 0.948 118.277 E94 +1 2 2 64 0.866 123.528 E94 +2 2 2 64 0.859 121.998 E94 +1 2 2 67 1.132 112.136 E94 +0 2 2 72 0.770 134.269 X94 +1 2 2 81 1.078 116.541 E94 +2 3 2 3 0.853 120.370 E94 +2 3 2 4 0.878 119.739 E94 +1 3 2 5 0.487 117.291 C94 +1 3 2 6 1.142 116.738 E94 +2 3 2 9 1.005 117.648 E94 +1 3 2 10 1.039 115.698 E94 +1 3 2 11 1.150 112.876 E94 +1 3 2 12 0.997 114.732 E94 +1 3 2 13 0.946 116.643 E94 +1 3 2 14 0.891 117.111 E94 +1 3 2 15 1.023 114.635 E94 +1 3 2 20 0.870 119.265 E94 +1 3 2 22 0.816 123.510 E94 +1 3 2 30 1.025 112.209 E94 +1 3 2 34 1.099 111.723 E94 +1 3 2 35 1.141 118.767 E94 +2 3 2 37 0.868 119.758 E94 +1 3 2 40 1.024 116.408 E94 +1 3 2 41 0.855 119.505 E94 +1 3 2 43 1.046 114.257 E94 +1 3 2 45 1.077 112.401 E94 +1 3 2 46 1.066 114.841 E94 +2 4 2 4 0.832 124.158 E94 +0 4 2 5 0.573 121.000 #E94 +1 4 2 5 0.545 120.000 #E94 +2 4 2 9 0.973 120.845 E94 +1 4 2 15 0.906 122.447 E94 +1 4 2 18 0.947 119.537 E94 +1 4 2 30 0.819 126.938 E94 +2 4 2 37 0.864 121.093 E94 +1 4 2 40 1.083 114.355 E94 +1 4 2 45 1.158 109.426 E94 +2 4 2 63 0.860 122.442 E94 +0 5 2 5 0.365 119.523 C94 +0 5 2 6 0.589 108.757 C94 +1 5 2 9 0.643 117.000 #E94 +0 5 2 10 0.667 114.859 E94 +0 5 2 11 0.795 108.186 X94 +0 5 2 12 0.622 110.650 X94 +0 5 2 13 0.566 113.513 E94 +0 5 2 15 0.546 119.562 E94 +0 5 2 17 0.492 124.000 #E94 +0 5 2 18 0.548 119.053 E94 +0 5 2 22 0.534 120.000 #E94 +0 5 2 25 0.395 124.000 #E94 +0 5 2 30 0.572 120.000 #E94 +0 5 2 35 0.682 124.164 X94 +1 5 2 37 0.491 117.423 C94 +1 5 2 39 0.655 115.724 E94 +0 5 2 40 0.568 112.322 C94 +0 5 2 41 0.294 123.706 C94 +0 5 2 45 0.728 107.774 X94 +0 5 2 55 0.651 116.000 #E94 +0 5 2 62 0.568 125.344 X94 +1 5 2 63 0.550 120.000 #E94 +1 5 2 64 0.546 120.000 #E94 +0 5 2 72 0.531 122.009 X94 +1 5 2 81 0.665 115.000 #E94 +1 6 2 9 1.214 120.520 E94 +0 6 2 10 1.311 115.921 E94 +0 6 2 22 1.080 120.560 E94 +0 6 2 35 1.172 132.391 E94 +1 6 2 37 1.198 114.441 E94 +0 6 2 40 1.239 119.073 E94 +0 6 2 45 1.637 102.438 E94 +1 9 2 10 1.098 119.802 E94 +1 9 2 15 0.915 127.574 E94 +2 9 2 37 0.981 119.536 E94 +1 9 2 40 0.922 130.521 E94 +0 10 2 12 1.144 112.723 E94 +0 10 2 15 1.078 117.519 E94 +0 10 2 25 1.144 100.818 E94 +1 10 2 37 1.021 117.139 E94 +0 10 2 40 0.988 126.034 E94 +0 10 2 41 0.951 120.000 E94 +0 12 2 12 1.012 119.105 E94 +0 12 2 17 1.110 114.206 E94 +0 12 2 18 1.201 110.553 E94 +0 12 2 19 0.704 126.646 E94 +0 12 2 20 0.903 120.563 E94 +0 12 2 30 0.892 122.753 E94 +1 12 2 37 0.976 116.136 E94 +0 12 2 45 1.076 115.543 E94 +0 13 2 18 1.132 113.616 E94 +0 15 2 15 0.996 123.027 E94 +0 15 2 35 0.950 133.654 E94 +1 15 2 37 1.007 115.757 E94 +0 15 2 40 0.895 128.924 E94 +0 17 2 17 1.051 117.955 E94 +1 18 2 37 1.183 106.608 E94 +0 22 2 22 0.841 122.108 E94 +3 22 2 22 0.180 58.963 E94 +1 22 2 37 0.806 124.693 E94 +1 30 2 37 0.849 123.816 E94 +1 35 2 37 0.991 128.032 E94 +0 40 2 40 0.949 128.436 E94 +0 40 2 56 1.072 120.987 E94 +1 40 2 63 0.922 124.268 E94 +1 40 2 64 0.955 121.881 E94 +0 40 2 72 0.820 135.317 E94 +0 45 2 45 1.284 108.095 E94 +2 64 2 64 0.888 120.342 E94 +0 0 3 0 0.000 117.300 0:*-3-* MMFF94 DEF +1 0 3 0 0.000 115.800 1:*-3-* MMFF94 DEF +4 0 3 0 0.000 90.800 4:*-3-* MMFF94 DEF +7 0 3 0 0.000 91.100 7:*-3-* MMFF94 DEF +8 0 3 0 0.000 88.900 7:*-3-* MMFF94 DEF +0 1 3 1 1.151 118.016 C94 +1 1 3 2 1.106 116.853 C94 +1 1 3 3 1.214 114.612 C94 +0 1 3 5 0.808 117.280 C94 +0 1 3 6 1.043 109.716 C94 +0 1 3 7 0.938 124.410 C94 +0 1 3 9 0.978 119.788 E94 +1 1 3 9 1.038 115.132 E94 +0 1 3 10 0.984 112.735 C94 +0 1 3 12 1.007 113.972 E94 +0 1 3 15 1.024 113.612 E94 +0 1 3 16 0.949 119.986 E94 +0 1 3 18 0.732 134.097 E94 +0 1 3 20 0.830 120.312 E94 +0 1 3 22 0.928 115.001 E94 +0 1 3 35 1.058 122.808 E94 +1 1 3 37 1.051 115.191 C94 +1 1 3 39 1.178 107.895 E94 +0 1 3 40 0.979 118.457 E94 +0 1 3 41 0.897 116.681 E94 +0 1 3 43 1.046 113.731 X94 +0 1 3 45 1.132 109.019 E94 +0 1 3 51 1.160 116.573 X94 +0 1 3 53 1.052 115.065 X94 +0 1 3 54 1.135 111.322 E94 +1 1 3 58 1.162 108.129 E94 +0 1 3 62 1.119 111.523 E94 +1 1 3 63 0.909 117.001 E94 +1 1 3 64 0.887 118.253 E94 +0 1 3 67 1.142 110.666 E94 +0 1 3 74 1.010 116.851 X94 +0 1 3 75 0.646 128.037 X94 +2 2 3 2 0.976 112.562 E94 +6 2 3 2 0.157 62.792 E94 +2 2 3 3 0.957 113.239 E94 +1 2 3 5 0.901 115.350 C94 +1 2 3 6 0.932 106.510 C94 +1 2 3 7 0.936 122.623 C94 +1 2 3 9 0.831 122.253 C94 +2 2 3 9 1.120 111.408 E94 +1 2 3 10 1.042 111.721 C94 +1 2 3 12 0.901 120.769 E94 +1 2 3 15 1.057 112.105 E94 +1 2 3 16 0.881 124.850 E94 +1 2 3 22 0.969 113.027 E94 +1 2 3 25 0.853 109.794 E94 +2 2 3 37 0.973 112.935 E94 +2 2 3 39 1.197 107.592 E94 +1 2 3 40 0.910 123.437 E94 +1 2 3 43 1.105 111.169 E94 +1 2 3 53 1.082 114.032 E94 +1 2 3 54 1.012 118.588 E94 +1 2 3 55 1.186 107.278 E94 +1 2 3 56 1.151 108.909 E94 +2 2 3 63 0.918 116.947 E94 +2 2 3 64 1.033 110.084 E94 +1 2 3 67 1.022 117.597 E94 +2 3 3 3 0.822 121.775 E94 +8 3 3 3 1.280 89.965 E94 +1 3 3 5 0.943 113.762 C94 +1 3 3 6 0.935 103.030 C94 +1 3 3 7 0.919 117.024 C94 +1 3 3 9 1.050 115.704 E94 +1 3 3 10 1.129 110.421 E94 +1 3 3 12 1.053 111.492 E94 +1 3 3 15 1.390 97.562 E94 +1 3 3 16 1.092 111.888 E94 +1 3 3 20 0.977 110.910 E94 +1 3 3 22 1.010 110.295 E94 +8 3 3 30 1.353 87.789 E94 +2 3 3 37 0.932 114.949 E94 +2 3 3 39 1.237 105.384 E94 +1 3 3 40 1.003 117.124 E94 +1 3 3 41 0.790 124.361 E94 +1 3 3 45 0.919 121.023 E94 +1 3 3 53 1.170 109.169 E94 +2 3 3 63 0.981 112.685 E94 +2 3 3 64 0.880 118.840 E94 +1 3 3 67 1.119 111.860 E94 +1 4 3 6 1.269 111.750 E94 +1 4 3 7 1.126 120.852 E94 +1 4 3 9 1.192 109.833 E94 +2 4 3 37 0.964 114.081 E94 +0 5 3 5 0.594 116.699 C94 +0 5 3 6 0.819 108.253 C94 +0 5 3 7 0.670 123.439 C94 +0 5 3 9 0.623 119.491 C94 +1 5 3 9 0.638 117.168 E94 +0 5 3 10 0.874 111.761 C94 +0 5 3 16 0.522 124.405 E94 +1 5 3 37 0.564 116.400 E94 +0 5 3 40 0.959 111.684 C94 +0 5 3 53 0.644 118.000 #E94 +0 5 3 54 0.816 115.471 C94 +1 5 3 63 0.559 118.000 #E94 +1 5 3 64 0.566 117.000 #E94 +0 5 3 67 0.700 113.698 E94 +0 6 3 6 1.678 109.094 E94 +0 6 3 7 1.155 124.425 C94 +0 6 3 9 1.275 119.478 E94 +1 6 3 9 1.416 111.868 E94 +0 6 3 10 1.405 112.187 E94 +0 6 3 16 1.269 116.317 E94 +0 6 3 20 1.182 113.581 E94 +4 6 3 20 1.495 93.130 E94 +0 6 3 22 1.276 110.826 E94 +7 6 3 30 1.530 93.191 E94 +1 6 3 37 0.808 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