0 mol 79 unq 0 iso 0 dist 7.74131 7.06029 6.82396 6.05149 11.1999 6.65972 8.71103 9.0655 8.14479 7.41952 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 9.59503 7.7399 14.5986 11.011 14.7844 4.91714 11.8411 19.2425 4.69684 7.12199 numMergedOcc 0
2 mol 92 unq 1 iso 0 dist 9.59503 7.7399 14.5986 11.011 14.7844 4.91714 16.5891 21.1156 9.94373 7.90837 numMergedOcc 0
3 mol 92 unq 2 iso 0 dist 9.61119 7.7399 17.052 11.011 19.1029 4.91714 11.8411 21.3714 4.69684 7.12199 numMergedOcc 0
4 mol 92 unq 3 iso 0 dist 9.61119 7.7399 17.052 11.011 19.1029 4.91714 16.5891 24.8994 9.94373 7.90837 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 9.0455 7.84813 3.54691 5.0466 7.13958 4.4077 8.63018 4.99299 6.14663 7.07421 numMergedOcc 0
6 mol 204 unq 0 iso 0 dist 9.91429 8.49554 5.04761 5.55359 11.6439 9.92651 7.19213 7.76556 3.72258 7.00683 numMergedOcc 0
7 mol 210 unq 0 iso 0 dist 9.718 9.49242 12.6983 13.3519 19.7875 7.95917 9.97171 14.6308 5.30972 6.41444 numMergedOcc 0
8 mol 210 unq 1 iso 0 dist 8.61629 9.49242 9.16249 13.3519 16.3076 7.95917 9.97171 10.936 5.30972 6.41444 numMergedOcc 0
9 mol 233 unq 0 iso 0 dist 9.06304 7.40498 8.15592 6.14114 9.94967 6.33954 11.2331 10.8544 5.41858 6.72499 numMergedOcc 0
10 mol 233 unq 1 iso 0 dist 9.06304 7.40498 8.15592 6.14114 9.94967 6.33954 12.7571 11.4538 9.32494 7.21238 numMergedOcc 0
11 mol 254 unq 0 iso 0 dist 9.03136 9.93669 3.67192 5.36654 5.17988 7.02613 11.4378 5.24816 7.04725 9.36171 numMergedOcc 0
12 mol 254 unq 1 iso 0 dist 9.03136 9.93669 3.67192 5.36654 5.17988 7.02613 12.2936 4.6577 3.99032 7.87218 numMergedOcc 0
13 mol 285 unq 0 iso 0 dist 8.12306 5.28731 10.1123 9.97666 17.9599 9.66678 17.2934 24.8153 16.8309 8.63954 numMergedOcc 0
14 mol 285 unq 1 iso 0 dist 8.12306 5.28731 10.1123 9.97666 17.9599 9.66678 12.3495 19.5908 10.6606 4.74716 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 9.39409 6.16127 11.7613 5.66584 6.76192 9.31611 12.4464 4.157 14.6969 8.0935 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 9.39409 6.16127 11.7613 5.66584 6.76192 9.31611 12.4464 4.157 14.6969 8.0935 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 9.39409 6.16127 11.7613 5.66584 6.76192 9.31611 12.4464 4.157 14.6969 8.0935 numMergedOcc 0
