0 mol 16 unq 0 iso 0 dist 6.36377 6.55076 8.33883 4.78943 5.05803 5.38671 9.05346 6.2983 5.77753 7.03948 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.36377 6.55076 8.33883 5.48395 6.31718 5.45161 9.05346 6.2983 5.77753 5.47769 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 6.36193 7.63046 7.84983 5.40367 6.62496 11.5882 11.074 10.2241 16.5678 9.58673 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 4.88613 7.63046 9.56737 5.40367 6.35756 11.5882 11.074 7.05413 16.5678 9.58673 numMergedOcc 0
4 mol 117 unq 0 iso 0 dist 6.90827 13.2842 9.85576 10.4485 7.90328 10.4589 9.58171 4.91401 12.907 6.62561 numMergedOcc 0
5 mol 117 unq 1 iso 0 dist 6.90827 13.2842 9.85576 5.27151 7.83136 14.2649 9.58171 4.91401 12.907 7.63616 numMergedOcc 0
6 mol 117 unq 2 iso 0 dist 8.90977 12.0106 9.85576 13.8755 7.90328 10.4589 13.2996 4.91401 12.907 6.62561 numMergedOcc 0
7 mol 117 unq 3 iso 0 dist 8.90977 12.0106 9.85576 10.6616 7.83136 14.2649 13.2996 4.91401 12.907 7.63616 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 6.18763 4.46648 6.49205 5.3154 6.18601 5.19198 12.0315 9.35964 13.9827 9.80862 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 6.18763 4.46648 6.49205 5.3154 6.18601 5.19198 10.2497 10.3457 12.9568 8.43904 numMergedOcc 0
10 mol 119 unq 2 iso 0 dist 5.63005 12.1048 9.42766 10.5268 8.73993 14.0677 13.4009 10.6679 19.0836 9.63176 numMergedOcc 0
11 mol 127 unq 0 iso 0 dist 9.42513 14.6411 8.40046 8.60326 9.30299 9.75166 16.2351 14.085 8.03243 8.59981 numMergedOcc 0
12 mol 127 unq 1 iso 0 dist 9.42513 14.6411 8.40046 8.60326 9.30299 9.75166 13.306 13.1312 14.4347 7.34519 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 9.51764 15.3761 8.49704 6.53326 8.85478 10.644 11.3587 6.67959 6.35728 7.46831 numMergedOcc 0
14 mol 214 unq 1 iso 0 dist 5.36829 8.72971 8.49704 12.3481 8.85478 10.644 10.5513 6.67959 6.35728 7.46831 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 8.39002 9.97999 9.33771 9.98893 8.95269 5.41021 14.5909 9.36098 10.8214 7.06793 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 8.39002 9.97999 9.33771 9.98893 8.95269 5.41021 11.3096 5.29877 6.4508 6.67585 numMergedOcc 0
17 mol 224 unq 2 iso 0 dist 8.39002 9.97999 9.33771 5.72088 6.57273 4.91322 11.3096 5.29877 6.4508 6.65984 numMergedOcc 0
18 mol 224 unq 3 iso 0 dist 8.46129 9.97999 7.39839 5.72088 6.60589 4.91322 11.3096 6.12232 6.4508 6.65984 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 9.07872 9.99433 9.64299 9.9474 7.09863 7.69739 16.431 9.13836 14.2244 8.17891 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 9.05929 6.83211 8.77254 4.38595 8.35971 10.054 10.3034 6.40312 13.6012 7.17676 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 9.05929 6.83211 8.77254 4.38595 8.35971 10.054 8.71945 6.2568 9.96007 6.68463 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 6.24928 9.87348 9.75174 5.33567 6.57393 13.477 8.81534 6.20606 12.9258 5.38637 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 9.13537 4.34203 6.83152 10.3859 6.57393 10.8336 17.1186 10.9761 16.8927 6.91569 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 9.54857 5.09929 7.93997 15.3806 7.46176 14.8465 10.5864 5.79468 9.27954 7.48005 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 8.19504 9.00704 6.75305 3.93713 6.24356 10.0289 11.0809 5.12409 9.67417 9.0012 numMergedOcc 0
26 mol 264 unq 1 iso 0 dist 8.19504 9.00704 6.75305 3.93713 6.24356 10.0289 11.1852 9.67998 13.3898 9.5784 numMergedOcc 0
