0 mol 52 unq 0 iso 0 dist 5.77748 5.63773 9.67023 4.98024 5.26018 6.86126 numMergedOcc 0
1 mol 52 unq 1 iso 0 dist 7.62062 5.09571 6.86785 9.99897 7.1203 6.55558 numMergedOcc 0
2 mol 52 unq 2 iso 0 dist 7.33436 5.75558 6.86785 6.01116 7.1203 6.55558 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 5.97144 11.6848 8.71615 10.0936 6.7212 5.46166 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 5.97144 11.6848 8.71615 9.19838 9.08821 5.58151 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 7.66116 6.9861 8.88685 10.4922 8.91446 10.7957 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 9.18318 16.5319 8.26758 12.3945 6.26542 10.844 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 9.18318 16.5319 8.26758 10.5786 7.02765 14.1618 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 5.92298 8.33452 8.26758 9.77595 6.26542 10.844 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 5.92298 8.33452 8.26758 12.1374 7.02765 14.1618 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 7.58293 6.82817 7.73836 6.03768 9.84673 6.42572 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.06422 5.09271 7.26463 12.3674 8.88255 9.35307 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 5.29346 4.13385 9.07096 7.79117 7.85527 11.2951 numMergedOcc 0
13 mol 140 unq 0 iso 0 dist 9.68237 10.9056 9.74209 10.553 7.83582 12.1389 numMergedOcc 0
14 mol 140 unq 1 iso 0 dist 9.68237 10.9056 9.74209 4.84803 9.89896 12.4171 numMergedOcc 0
15 mol 140 unq 2 iso 0 dist 9.68237 10.9056 9.74209 8.69462 9.68229 16.7631 numMergedOcc 0
16 mol 212 unq 0 iso 0 dist 9.52641 5.75285 6.41916 10.1617 9.47932 9.7586 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 8.1177 13.6663 5.98076 6.40429 4.851 8.31343 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 4.88851 5.93446 9.78444 4.9585 8.7017 7.87566 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 9.4691 11.224 9.35766 5.34337 7.26981 9.56248 numMergedOcc 0
