0 mol 13 unq 0 iso 0 dist 5.4424 4.43066 3.53348 4.14738 8.05984 7.98465 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 6.02034 7.32064 8.76068 10.1263 13.1616 5.47706 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 6.02034 5.85007 11.6562 10.1263 13.1616 8.07568 numMergedOcc 0
3 mol 78 unq 2 iso 0 dist 6.77808 4.62314 8.76068 6.88255 13.1616 5.47706 numMergedOcc 0
4 mol 78 unq 3 iso 0 dist 6.77808 6.35234 11.6562 6.88255 13.1616 8.07568 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 5.57712 9.43496 12.6233 15.7577 20.5568 9.39807 numMergedOcc 0
6 mol 112 unq 0 iso 0 dist 6.30128 4.77996 5.96497 6.40435 7.12413 6.12922 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.39253 5.90003 4.80926 6.02826 11.1985 6.55202 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.68599 9.76097 6.95933 6.11049 8.49888 8.50705 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.49104 9.13697 4.56331 5.90631 8.33489 5.52149 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.32669 5.56446 7.13673 7.03121 9.81842 4.26972 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 6.32669 5.56446 7.13673 5.65619 11.7504 7.54341 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 9.0153 9.48766 4.65091 4.04021 8.55725 9.32333 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.46728 8.56975 12.4194 14.0686 10.2991 9.84652 numMergedOcc 0
14 mol 259 unq 0 iso 0 dist 7.97113 4.95855 10.2743 4.09442 11.8224 6.23661 numMergedOcc 0
15 mol 259 unq 1 iso 0 dist 5.22111 4.95855 7.06301 4.09442 9.27954 6.23661 numMergedOcc 0
16 mol 273 unq 0 iso 0 dist 9.52454 8.89714 9.32473 14.6301 17.5506 9.06937 numMergedOcc 0
17 mol 274 unq 0 iso 0 dist 8.26851 4.97796 5.9397 5.95459 5.42845 6.66172 numMergedOcc 0
18 mol 274 unq 1 iso 0 dist 8.14634 4.97796 4.89003 5.95459 5.62484 6.66172 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 7.90132 8.4275 12.1132 6.40657 12.0328 9.60574 numMergedOcc 0
