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cpp20
pymol-open-source/testing/data/heat1.crd
Thomas Holder 531bc07387 testLoadTOP
2015-04-20 18:40:22 -04:00

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47.208 20.951 3.968 47.383 19.977 5.857 47.048 20.421 6.795 47.147
18.913 5.887 48.908 20.132 5.771 49.461 20.389 4.696 49.586 19.986
6.918 49.050 19.753 7.742 51.044 20.152 7.098 51.544 19.858 6.175
51.314 21.653 7.359 50.785 22.237 6.606 50.914 21.928 8.336 52.798
22.045 7.292 53.343 21.552 8.097 53.202 21.728 6.330 52.999 23.559
7.426 52.434 24.056 6.638 52.616 23.882 8.394 54.428 23.918 7.312
55.090 23.156 7.271 54.938 25.135 7.248 54.195 26.205 7.301 53.195
26.104 7.401 54.609 27.124 7.250 56.224 25.302 7.127 56.839 24.502
7.078 56.614 26.232 7.077 51.562 19.264 8.256 50.786 18.996 9.181
52.838 18.817 8.252 53.719 18.756 7.090 54.149 19.738 6.889 53.198
18.383 6.209 54.842 17.797 7.471 55.771 18.033 6.952 54.535 16.772
7.264 54.961 18.003 8.977 55.555 18.896 9.174 55.408 17.133 9.457
53.509 18.228 9.422 53.046 17.260 9.612 53.430 19.088 10.713 53.029
20.257 10.645 53.803 18.540 11.893 54.288 17.176 12.085 55.340 17.126
11.805 53.711 16.450 11.511 54.149 16.877 13.575 54.909 16.175 13.920
53.149 16.495 13.782 54.315 18.251 14.212 55.376 18.488 14.288 53.843
18.300 15.194 53.637 19.186 13.205 52.565 19.190 13.405 54.197 20.625
13.338 55.135 20.986 12.616 53.660 21.444 14.273 52.562 21.104 15.176
52.943 20.489 15.991 51.749 20.591 14.662 52.037 22.425 15.731 51.632
22.309 16.737 51.283 22.831 15.057 53.272 23.317 15.713 53.863 23.125
16.609 53.005 24.372 15.654 54.033 22.852 14.466 53.661 23.412 13.607
55.539 23.133 14.625 56.295 22.324 15.178 55.953 24.328 14.179 55.252
24.936 13.781 57.327 24.863 14.234 57.887 24.343 15.011 58.023 24.604
12.894 57.914 23.552 12.631 57.559 25.207 12.114 59.401 24.922 13.011
59.838 24.734 12.177 57.329 26.357 14.590 56.656 27.146 13.885 57.954
26.728 15.611
3.718 1.756 0.048 4.146 1.266 -0.724 2.722 1.796 -0.112 3.890
1.229 0.892 4.282 3.125 0.174 4.098 3.657 -0.759 3.600 3.913
1.316 2.517 3.881 1.194 3.843 3.451 2.272 4.020 5.384 1.345
4.330 5.984 0.325 4.057 6.013 2.503 4.332 6.985 2.518 3.802
5.540 3.359 5.799 3.054 0.378 6.272 2.233 1.166 6.568 3.891
-0.330 6.115 4.574 -0.920 8.037 3.950 -0.272 8.366 3.587 0.702
8.600 3.023 -1.371 8.194 2.022 -1.224 8.245 3.385 -2.336 10.139
2.918 -1.431 10.568 3.906 -1.599 10.738 2.326 -0.152 10.309 1.343
0.040 11.818 2.228 -0.265 10.546 2.975 0.702 10.549 2.021 -2.599
10.162 2.433 -3.531 11.636 1.974 -2.664 10.152 1.015 -2.458 8.546
5.397 -0.439 7.984 6.175 -1.213 9.627 5.741 0.265 10.036 5.051
0.878 10.324 7.032 0.178 10.094 7.500 -0.779 9.819 7.952 1.302
8.738 8.054 1.213 10.026 7.482 2.264 10.431 9.340 1.288 11.470
9.672 2.183 11.827 8.942 2.895 12.039 10.962 2.158 12.827 11.219
2.850 11.581 11.919 1.225 12.120 13.168 1.189 12.802 13.283 1.855
10.547 11.581 0.326 10.204 12.316 -0.387 9.975 10.294 0.357 9.184
10.039 -0.333 11.851 6.845 0.255 12.338 5.914 0.905 12.608 7.729
-0.400 12.141 8.477 -0.892 14.081 7.760 -0.391 14.420 7.351 0.560
14.643 6.857 -1.520 14.202 5.869 -1.384 14.251 7.343 -2.930 14.761
8.276 -3.169 14.520 6.593 -3.673 13.174 7.499 -2.993 16.173 6.694
-1.378 16.671 7.634 -1.616 16.402 6.439 -0.343 16.767 5.594 -2.267
16.682 5.867 -3.319 17.822 5.467 -2.026 16.247 4.652 -2.091 14.603
9.207 -0.476 14.017 10.047 -1.163 15.701 9.501 0.228 16.126 8.765
0.774 16.358 10.814 0.265 16.187 11.329 -0.680 15.721 11.640 1.398
14.641 11.631 1.253 15.941 11.170 2.357 16.181 13.108 1.436 17.258
13.144 1.603 15.969 13.581 0.477 15.489 13.918 2.538 14.365 13.655
2.951 16.127 14.943 3.063 15.667 15.470 3.792 17.053 15.191 2.744
17.877 10.662 0.469 18.323 9.838 1.272 18.669 11.474 -0.238 18.233
12.130 -0.871 20.136 11.541 -0.130 20.432 11.252 0.879 20.763 10.551
-1.123 20.434 9.543 -0.870 20.392 10.780 -2.122 22.263 10.553 -1.156
23.023 10.906 -2.218 22.638 11.213 -3.179 24.361 10.828 -1.879 25.108
11.043 -2.524 24.532 10.431 -0.568 25.665 10.228 0.232 26.650 10.397
-0.176 25.497 9.812 1.565 26.357 9.649 2.197 24.203 9.601 2.074
24.078 9.277 3.096 23.071 9.806 1.260 22.085 9.633 1.666 23.204
10.232 -0.081 20.656 12.970 -0.373 20.037 13.744 -1.109 21.790 13.321
0.246 22.255 12.619 0.804 22.462 14.622 0.133 22.230 15.052 -0.842
21.901 15.543 1.239 20.816 15.581 1.142 22.128 15.093 2.206 22.434
16.990 1.240 23.517 16.980 1.360 22.081 17.745 -0.045 21.001 17.747
-0.191 22.435 18.773 0.026 22.563 17.282 -0.906 21.833 17.758 2.418
22.091 17.261 3.353 22.233 18.772 2.440 20.748 17.806 2.325 23.993
14.465 0.244 24.480 13.620 1.000 24.746 15.305 -0.480 24.263 15.974
-1.062 26.219 15.374 -0.473 26.597 14.879 0.421 26.750 14.619 -1.710
26.326 13.615 -1.713 26.420 15.132 -2.613 28.283 14.493 -1.729 28.731
15.485 -1.791 28.612 14.008 -0.811 28.755 13.667 -2.934 28.336 12.663
-2.868 28.406 14.140 -3.852 30.286 13.589 -2.948 30.688 14.602 -2.967
30.622 13.117 -2.024 30.784 12.821 -4.119 30.500 13.250 -4.988 31.793
12.775 -4.121 30.437 11.873 -4.111 26.699 16.832 -0.431 26.080 17.711
-1.032 27.804 17.081 0.270 28.268 16.296 0.705 28.446 18.397 0.436
28.190 19.038 -0.407 27.902 19.039 1.725 26.816 19.104 1.660 28.146
18.393 2.568 28.465 20.449 1.967 28.303 21.323 1.081 29.078 20.685
3.036 29.988 18.266 0.480 30.517 17.208 0.835 30.716 19.332 0.128
30.234 20.179 -0.137 32.185 19.377 0.153 32.539 19.040 1.128 32.580
18.695 -0.600 32.773 20.773 -0.110 32.051 21.720 -0.436 34.096 20.899
0.029 34.630 20.080 0.285 34.843 22.152 -0.155 34.632 22.548 -1.149
34.502 22.881 0.580 36.369 21.994 -0.010 36.854 20.866 0.154 37.138
23.101 -0.080 36.656 24.446 -0.372 36.240 24.886 0.534 35.911 24.448
-1.168 37.885 25.238 -0.812 37.786 26.299 -0.585 38.056 25.086 -1.878
39.012 24.587 -0.014 39.036 25.023 0.985 39.977 24.712 -0.505 38.600
23.111 0.061 39.028 22.583 -0.791 39.123 22.477 1.363 38.469 22.529
2.410 40.335 21.915 1.304 40.821 21.933 0.419 41.055 21.321 2.445
40.744 21.820 3.362 40.690 19.834 2.559 39.606 19.731 2.536 41.112
19.289 1.714 41.175 19.292 3.778 40.909 18.371 3.825 42.578 21.493
2.304 43.094 21.661 1.193 43.303 21.464 3.426 42.816 21.257 4.286
44.769 21.585 3.503 45.210 21.136 2.613 45.149 23.074 3.533 44.611
23.594 2.740 44.860 23.505 4.491 46.542 23.245 3.320 46.732 24.186
3.318 45.339 20.857 4.735 44.602 20.537 5.675 46.652 20.604 4.747
47.198 20.944 3.969 47.378 19.974 5.859 47.041 20.414 6.797 47.147
18.909 5.886 48.903 20.134 5.773 49.458 20.395 4.700 49.580 19.986
6.920 49.043 19.759 7.745 51.037 20.155 7.102 51.540 19.867 6.179
51.301 21.655 7.372 50.769 22.240 6.622 50.900 21.923 8.350 52.782
22.058 7.306 53.331 21.565 8.108 53.188 21.748 6.343 52.969 23.572
7.449 52.399 24.070 6.665 52.586 23.886 8.421 54.396 23.940 7.335
55.063 23.182 7.295 54.899 25.161 7.272 54.147 26.225 7.326 53.148
26.117 7.429 54.555 27.148 7.276 56.184 25.340 7.151 56.807 24.546
7.102 56.565 26.274 7.102 51.555 19.266 8.259 50.780 18.997 9.185
52.831 18.821 8.251 53.712 18.767 7.088 54.140 19.750 6.891 53.190
18.397 6.206 54.835 17.806 7.463 55.765 18.047 6.946 54.528 16.783
7.248 54.953 18.001 8.971 55.550 18.890 9.174 55.397 17.126 9.446
53.502 18.228 9.419 53.037 17.260 9.607 53.425 19.086 10.712 53.025
20.255 10.644 53.794 18.536 11.892 54.270 17.168 12.083 55.322 17.112
11.804 53.690 16.446 11.509 54.129 16.871 13.574 54.883 16.164 13.920
53.126 16.496 13.781 54.305 18.246 14.209 55.368 18.475 14.282 53.835
18.300 15.191 53.632 19.185 13.202 52.560 19.195 13.402 54.200 20.621
13.331 55.150 20.970 12.617 53.659 21.453 14.252 52.549 21.129 15.145
52.916 20.520 15.972 51.738 20.616 14.627 52.027 22.460 15.679 51.606
22.358 16.680 51.288 22.865 14.989 53.270 23.341 15.672 53.849 23.149
16.575 53.014 24.398 15.602 54.041 22.861 14.436 53.682 23.416 13.569
55.546 23.134 14.612 56.290 22.323 15.176 55.974 24.322 14.163 55.285
24.931 13.746 57.351 24.848 14.241 57.893 24.331 15.033 58.069 24.577
12.917 57.958 23.524 12.656 57.624 25.180 12.125 59.446 24.887 13.057
59.890 24.720 12.223 57.352 26.344 14.583 56.691 27.128 13.860 57.962
26.725 15.609
3.723 1.768 0.049 4.146 1.279 -0.727 2.726 1.811 -0.106 3.898
1.238 0.891 4.291 3.135 0.177 4.107 3.667 -0.757 3.609 3.925
1.317 2.526 3.900 1.189 3.844 3.460 2.274 4.036 5.394 1.350
4.346 5.996 0.330 4.082 6.021 2.510 4.361 6.991 2.524 3.822
5.550 3.365 5.810 3.065 0.378 6.286 2.246 1.165 6.579 3.901
-0.330 6.126 4.582 -0.923 8.049 3.960 -0.272 8.377 3.599 0.702
8.615 3.029 -1.368 8.216 2.027 -1.212 8.257 3.381 -2.335 10.154
2.931 -1.431 10.578 3.920 -1.603 10.757 2.347 -0.151 10.329 1.364
0.049 11.836 2.251 -0.265 10.565 3.002 0.699 10.564 2.033 -2.597
10.176 2.444 -3.529 11.651 1.989 -2.663 10.170 1.027 -2.455 8.554
5.407 -0.438 7.989 6.183 -1.212 9.640 5.750 0.262 10.054 5.054
0.865 10.340 7.038 0.175 10.107 7.510 -0.780 9.842 7.953 1.304
8.760 8.053 1.222 10.057 7.482 2.264 10.449 9.343 1.284 11.498
9.675 2.166 11.867 8.941 2.867 12.062 10.965 2.143 12.859 11.222
2.825 11.584 11.929 1.226 12.114 13.181 1.190 12.804 13.298 1.847
10.537 11.593 0.341 10.175 12.333 -0.358 9.971 10.303 0.371 9.167
10.052 -0.305 11.867 6.845 0.246 12.351 5.917 0.901 12.624 7.724
-0.418 12.158 8.476 -0.905 14.096 7.759 -0.403 14.430 7.359 0.554
14.668 6.844 -1.517 14.226 5.858 -1.377 14.285 7.320 -2.932 14.786
8.258 -3.169 14.571 6.570 -3.670 13.207 7.462 -3.006 16.197 6.683
-1.362 16.695 7.622 -1.603 16.419 6.437 -0.323 16.799 5.579 -2.240
16.711 5.840 -3.294 17.857 5.463 -2.000 16.289 4.634 -2.053 14.613
9.207 -0.492 14.034 10.042 -1.193 15.703 9.503 0.224 16.122 8.771
0.780 16.361 10.818 0.259 16.193 11.330 -0.689 15.716 11.647 1.383
14.638 11.649 1.221 15.915 11.171 2.344 16.188 13.110 1.437 17.261
13.132 1.625 16.000 13.591 0.477 15.488 13.920 2.534 14.358 13.662
2.931 16.132 14.932 3.078 15.663 15.464 3.797 17.062 15.175 2.768
17.880 10.671 0.467 18.326 9.845 1.267 18.673 11.481 -0.244 18.237
12.128 -0.885 20.136 11.554 -0.126 20.429 11.258 0.881 20.769 10.576
-1.127 20.443 9.565 -0.882 20.398 10.810 -2.125 22.268 10.582 -1.159
23.032 10.995 -2.197 22.651 11.348 -3.144 24.367 10.916 -1.854 25.113
11.170 -2.486 24.534 10.459 -0.563 25.665 10.225 0.232 26.652 10.418
-0.161 25.490 9.745 1.545 26.346 9.563 2.178 24.194 9.500 2.034
24.063 9.129 3.040 23.066 9.737 1.226 22.078 9.542 1.616 23.204
10.223 -0.094 20.648 12.988 -0.355 20.036 13.767 -1.093 21.778 13.332
0.271 22.239 12.627 0.828 22.457 14.629 0.154 22.234 15.050 -0.826
21.893 15.567 1.244 20.809 15.611 1.137 22.112 15.127 2.217 22.435
17.010 1.233 23.517 16.996 1.363 22.096 17.754 -0.060 21.017 17.756
-0.219 22.449 18.783 0.005 22.588 17.286 -0.912 21.830 17.797 2.396
22.083 17.310 3.338 22.235 18.808 2.408 20.746 17.846 2.296 23.987
14.464 0.272 24.467 13.628 1.043 24.744 15.288 -0.466 24.266 15.948
-1.063 26.219 15.356 -0.460 26.595 14.863 0.436 26.742 14.591 -1.692
26.316 13.588 -1.686 26.407 15.101 -2.596 28.274 14.462 -1.726 28.721
15.454 -1.791 28.613 13.974 -0.813 28.732 13.643 -2.940 28.309 12.640
-2.878 28.380 14.125 -3.851 30.264 13.558 -2.968 30.667 14.570 -2.986
30.606 13.080 -2.050 30.748 12.796 -4.149 30.457 13.232 -5.012 31.756
12.747 -4.159 30.397 11.849 -4.145 26.708 16.813 -0.427 26.093 17.693
-1.032 27.810 17.063 0.281 28.263 16.282 0.732 28.446 18.381 0.446
28.192 19.016 -0.403 27.891 19.031 1.725 26.805 19.095 1.648 28.126
18.391 2.576 28.449 20.444 1.963 28.285 21.311 1.072 29.053 20.690
3.034 29.985 18.258 0.497 30.517 17.206 0.864 30.710 19.324 0.141
30.226 20.169 -0.129 32.178 19.374 0.176 32.524 19.047 1.157 32.579
18.685 -0.567 32.767 20.766 -0.095 32.044 21.712 -0.426 34.089 20.894
0.046 34.622 20.076 0.307 34.835 22.146 -0.147 34.622 22.538 -1.142
34.497 22.879 0.585 36.362 21.988 -0.006 36.847 20.862 0.163 37.134
23.092 -0.084 36.656 24.436 -0.385 36.240 24.884 0.518 35.913 24.434
-1.182 37.887 25.221 -0.831 37.791 26.285 -0.612 38.057 25.061 -1.896
39.011 24.572 -0.030 39.037 25.012 0.966 39.976 24.693 -0.522 38.597
23.097 0.052 39.020 22.564 -0.800 39.121 22.466 1.356 38.470 22.529
2.403 40.330 21.899 1.299 40.817 21.913 0.414 41.049 21.306 2.440
40.737 21.806 3.357 40.685 19.821 2.556 39.601 19.716 2.531 41.110
19.274 1.714 41.168 19.283 3.777 40.897 18.364 3.830 42.572 21.477
2.301 43.089 21.639 1.190 43.297 21.452 3.424 42.810 21.246 4.285
44.763 21.580 3.500 45.206 21.130 2.612 45.141 23.069 3.530 44.603
23.591 2.739 44.855 23.499 4.490 46.535 23.240 3.317 46.723 24.181
3.295 45.333 20.856 4.734 44.597 20.537 5.675 46.645 20.601 4.748
47.193 20.938 3.970 47.367 19.969 5.861 47.028 20.407 6.800 47.139
18.903 5.886 48.892 20.135 5.777 49.446 20.402 4.705 49.571 19.986
6.923 49.036 19.744 7.745 51.027 20.161 7.105 51.533 19.881 6.181
51.285 21.659 7.390 50.746 22.250 6.650 50.890 21.913 8.374 52.764
22.069 7.321 53.319 21.574 8.119 53.169 21.768 6.355 52.939 23.584
7.474 52.364 24.081 6.693 52.553 23.889 8.447 54.362 23.965 7.361
55.035 23.214 7.318 54.853 25.191 7.300 54.092 26.249 7.355 53.094
26.133 7.454 54.492 27.175 7.305 56.136 25.381 7.179 56.766 24.592
7.129 56.510 26.318 7.130 51.545 19.270 8.258 50.767 19.002 9.181
52.822 18.827 8.250 53.705 18.779 7.089 54.133 19.764 6.901 53.184
18.417 6.203 54.829 17.816 7.458 55.758 18.063 6.944 54.525 16.793
7.237 54.945 18.004 8.967 55.540 18.893 9.174 55.390 17.128 9.439
53.493 18.228 9.415 53.028 17.260 9.600 53.420 19.084 10.710 53.030
20.255 10.647 53.785 18.531 11.889 54.252 17.161 12.079 55.303 17.094
11.797 53.662 16.444 11.509 54.108 16.868 13.570 54.853 16.152 13.917
53.101 16.503 13.773 54.293 18.240 14.207 55.357 18.461 14.286 53.817
18.294 15.186 53.629 19.184 13.199 52.558 19.202 13.399 54.207 20.617
13.322 55.164 20.953 12.613 53.659 21.461 14.229 52.533 21.160 15.110
52.883 20.557 15.949 51.725 20.648 14.588 52.017 22.502 15.623 51.583
22.415 16.620 51.290 22.908 14.920 53.270 23.368 15.623 53.837 23.174
16.534 53.029 24.428 15.545 54.049 22.868 14.399 53.706 23.416 13.522
55.554 23.130 14.593 56.281 22.318 15.178 55.997 24.313 14.146 55.318
24.926 13.719 57.375 24.833 14.248 57.897 24.321 15.056 58.120 24.546
12.941 58.007 23.492 12.688 57.696 25.144 12.135 59.497 24.846 13.108
59.956 24.677 12.282 57.378 26.333 14.576 56.735 27.112 13.832 57.971
26.721 15.609
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