0 mol 7 unq 0 iso 0 dist 6.8464 5.0893 8.41585 14.0737 12.8323 9.87885 11.4481 7.88043 10.2446 8.15894 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.8464 5.0893 8.41585 14.0737 12.8323 9.87885 13.9708 8.80762 12.3097 8.45544 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.0319 11.4109 6.86014 12.1911 5.69214 7.95042 17.188 10.7114 6.58998 8.24948 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.03754 14.0204 8.80331 12.8366 5.41726 6.6263 17.4354 10.0649 7.05402 7.15901 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.03754 13.1056 6.20293 12.8366 5.41726 6.75943 17.4354 10.0649 5.48048 7.15901 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 9.47348 9.92508 8.93915 15.6164 10.0383 6.75943 14.7712 13.5072 5.48048 7.15901 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.11695 14.4144 9.33898 11.295 4.3481 7.06939 10.9332 6.61823 6.08245 6.9223 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 7.11695 14.4144 9.33898 11.295 4.3481 7.06939 8.98815 6.49956 6.86728 7.0561 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 7.11695 9.54167 9.64443 10.9777 5.31547 9.36001 10.9332 6.61823 7.24315 6.98037 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.86784 6.65283 6.49416 15.2447 12.3479 9.33094 15.6559 13.846 9.4027 5.11043 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 9.16358 10.0911 8.94367 14.33 7.41373 9.33094 11.868 8.20836 9.4027 5.11043 numMergedOcc 0
11 mol 134 unq 2 iso 0 dist 9.16358 9.66197 9.86662 17.7356 12.8086 9.1998 11.868 8.20836 5.12325 6.99345 numMergedOcc 0
12 mol 134 unq 3 iso 0 dist 9.16358 9.66197 9.86662 14.33 7.41373 8.69531 11.868 8.20836 5.12325 5.11043 numMergedOcc 0
13 mol 134 unq 4 iso 0 dist 6.48328 10.0911 6.37586 14.33 10.8635 9.33094 11.868 10.873 9.4027 5.11043 numMergedOcc 0
14 mol 134 unq 5 iso 0 dist 6.48328 9.66197 9.71307 17.7356 15.0225 9.1998 11.868 10.873 5.12325 6.99345 numMergedOcc 0
15 mol 134 unq 6 iso 0 dist 6.48328 9.66197 9.71307 14.33 10.8635 8.69531 11.868 10.873 5.12325 5.11043 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 8.41774 13.1435 8.56324 12.9285 5.39112 6.59889 17.8722 10.4911 7.2238 7.1069 numMergedOcc 0
17 mol 152 unq 1 iso 0 dist 8.41774 13.793 6.70283 12.9285 5.39112 6.70693 17.8722 10.4911 5.59336 7.1069 numMergedOcc 0
18 mol 170 unq 0 iso 0 dist 9.32245 6.45787 9.76807 9.66676 4.78249 9.51256 11.0716 8.15099 7.72147 5.13268 numMergedOcc 0
19 mol 178 unq 0 iso 0 dist 9.63185 14.4816 6.69288 14.7977 6.42973 7.06025 6.80181 4.92088 10.1489 8.25282 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 7.51951 5.04299 7.26832 10.4944 13.514 6.52816 7.19763 10.0424 5.54129 7.53395 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 4.80834 7.04671 5.72887 5.52788 7.06793 9.72188 10.1787 11.2809 10.7551 6.53286 numMergedOcc 0
