0 mol 32 unq 0 iso 0 dist 9.28158 7.33936 4.57338 14.036 11.4833 8.68559 7.9487 9.83819 7.18766 7.93694 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 9.28158 7.33936 4.57338 14.036 11.4833 8.68559 12.0126 11.7245 7.48825 6.68431 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 5.41357 8.64746 4.97497 9.95527 8.75668 8.68586 6.10515 7.7933 8.4517 5.35421 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 5.41357 8.64746 4.97497 6.41829 9.64871 9.54144 6.10515 7.7933 8.4517 5.68303 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 9.30042 8.64746 6.60091 9.95527 12.8796 8.68586 6.10515 12.4521 8.4517 5.35421 numMergedOcc 0
5 mol 64 unq 3 iso 0 dist 9.30042 8.64746 6.60091 6.41829 13.3367 9.54144 6.10515 12.4521 8.4517 5.68303 numMergedOcc 0
6 mol 99 unq 0 iso 0 dist 8.68674 9.46619 6.83905 11.4646 12.9268 7.72108 7.35957 11.2459 6.6925 5.81128 numMergedOcc 0
7 mol 99 unq 1 iso 0 dist 8.68674 9.46619 6.83905 11.4646 12.9268 7.72108 8.5606 9.58975 7.12746 4.91474 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 7.93793 5.45159 8.53498 5.9827 12.6241 6.192 10.5932 14.7054 6.3244 8.00931 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 7.93793 5.45159 8.53498 7.79941 14.9222 7.69308 10.5932 14.7054 6.3244 6.85862 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 7.93793 5.45159 8.53498 13.8098 15.9068 8.59981 10.5932 14.7054 6.3244 4.77464 numMergedOcc 0
11 mol 127 unq 3 iso 0 dist 7.93793 5.45159 8.53498 12.0185 14.1377 7.66331 10.5932 14.7054 6.3244 7.11695 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.76088 6.61636 12.398 14.1314 20.0949 7.92688 10.6348 17.1534 9.94276 11.8989 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 8.76088 6.61636 12.398 14.1314 20.0949 7.92688 6.47676 10.2366 9.05357 15.0734 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 8.76088 6.61636 12.398 14.1314 20.0949 7.92688 6.95294 15.3705 5.99299 9.58627 numMergedOcc 0
15 mol 187 unq 0 iso 0 dist 5.58167 7.9625 10.7843 4.98423 6.82787 9.27478 8.43209 12.2628 7.01496 6.62321 numMergedOcc 0
16 mol 187 unq 1 iso 0 dist 8.0501 7.9625 9.27977 4.98423 12.7503 9.27478 8.43209 12.9656 7.01496 6.62321 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 6.23677 8.76325 4.76056 6.87755 7.49783 7.06793 6.78713 9.89345 8.89778 7.98696 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 7.31608 8.85101 4.76056 11.0252 7.49783 7.06793 7.09867 9.89345 8.89778 7.98696 numMergedOcc 0
19 mol 224 unq 2 iso 0 dist 7.96226 8.85101 4.1117 11.0252 10.6915 7.06793 7.09867 10.811 8.89778 7.98696 numMergedOcc 0
20 mol 228 unq 0 iso 0 dist 9.9685 7.95486 13.9493 5.79543 15.686 7.77367 6.22795 14.9114 8.07174 4.75417 numMergedOcc 0
21 mol 228 unq 1 iso 0 dist 9.9685 7.95486 13.9493 10.4968 19.78 8.20909 6.22795 14.9114 8.07174 6.53802 numMergedOcc 0
22 mol 228 unq 2 iso 0 dist 9.9685 7.95486 13.9493 14.5051 21.545 7.94506 6.22795 14.9114 8.07174 11.0908 numMergedOcc 0
23 mol 228 unq 3 iso 0 dist 9.9685 7.95486 13.9493 10.0847 18.7846 8.15494 6.22795 14.9114 8.07174 10.0837 numMergedOcc 0
24 mol 228 unq 4 iso 0 dist 9.9685 4.42593 7.98833 5.79543 15.686 9.06121 6.22795 14.9114 7.09766 4.75417 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 8.58092 6.73928 11.8838 4.6881 11.1621 6.49982 6.42545 14.9076 7.16259 5.95565 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 9.86267 9.44826 3.83813 7.02254 6.11671 7.50578 12.0966 11.9494 8.76313 11.5772 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 9.86267 9.44826 3.83813 7.02254 6.11671 7.50578 5.92281 9.60653 7.4363 7.44916 numMergedOcc 0
28 mol 293 unq 0 iso 0 dist 4.72125 8.88355 10.4612 6.91752 11.5814 9.97212 6.17637 10.1006 9.70656 5.82671 numMergedOcc 0
29 mol 293 unq 1 iso 0 dist 4.72125 8.88355 10.4612 6.91752 11.5814 9.97212 7.77971 10.6115 6.33356 8.15509 numMergedOcc 0
