0 mol 33 unq 0 iso 0 dist 8.41282 8.66089 9.1841 6.08005 9.63263 11.3207 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 8.41282 6.9181 10.6011 6.08005 9.63263 12.2097 numMergedOcc 0
2 mol 33 unq 2 iso 0 dist 8.41282 5.84349 11.7716 6.08005 9.63263 11.8372 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.10096 9.80869 9.20886 11.5552 6.77886 15.5626 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 8.98939 8.26586 6.0309 8.89982 7.27383 11.7132 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 8.98939 9.76234 11.5843 8.89982 7.27383 14.4498 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 8.64047 6.24296 12.7386 13.4816 8.00777 15.9486 numMergedOcc 0
7 mol 85 unq 1 iso 0 dist 8.64047 6.24296 12.7386 12.1235 7.1589 13.3997 numMergedOcc 0
8 mol 85 unq 2 iso 0 dist 8.64047 6.83218 14.1999 13.4816 8.00777 16.3916 numMergedOcc 0
9 mol 85 unq 3 iso 0 dist 8.64047 6.83218 14.1999 12.1235 7.1589 14.6517 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 9.70095 8.29463 12.068 5.06206 7.12017 5.35782 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 9.67785 6.6142 5.14267 6.2092 9.44561 8.11052 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.97579 4.54218 5.25982 10.5394 6.69515 8.07097 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 6.97579 4.54218 5.25982 12.1215 7.86572 11.5913 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 6.96911 7.96394 14.2552 8.96288 7.73169 16.5619 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 6.96911 8.01381 7.79956 8.96288 7.73169 14.4988 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.18314 7.81696 11.924 7.37734 9.83476 7.85184 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 7.84953 5.4767 13.0451 6.66456 6.29367 11.5084 numMergedOcc 0
18 mol 218 unq 1 iso 0 dist 7.84953 5.4767 13.0451 5.09263 5.76954 9.24601 numMergedOcc 0
19 mol 218 unq 2 iso 0 dist 7.84953 5.4767 13.0451 10.1782 9.20961 13.6075 numMergedOcc 0
20 mol 218 unq 3 iso 0 dist 4.57726 5.4767 3.85314 6.66456 8.86175 11.5084 numMergedOcc 0
21 mol 218 unq 4 iso 0 dist 4.57726 5.4767 3.85314 5.09263 6.29511 9.24601 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 7.10883 7.9002 6.35462 6.7444 6.6561 6.50998 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 7.92391 9.1946 7.38812 4.97892 7.71657 12.0634 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 6.69569 9.98518 13.2109 15.9188 9.74402 21.3667 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 6.69569 9.98518 13.2109 15.9188 9.74402 21.3667 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 6.69569 9.98518 13.2109 15.9188 9.74402 21.3667 numMergedOcc 0
