0 mol 59 unq 0 iso 0 dist 9.05547 8.10708 14.134 9.64474 17.9165 8.42956 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 9.05547 8.10708 14.134 7.07517 12.9592 9.20253 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.7754 8.18002 13.6262 11.2311 20.0567 9.01261 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 7.16583 7.14313 10.0425 11.6648 13.0751 8.26819 numMergedOcc 0
4 mol 94 unq 0 iso 0 dist 9.10488 5.20598 10.0455 10.6772 16.0551 9.09847 numMergedOcc 0
5 mol 143 unq 0 iso 0 dist 7.5984 8.57285 5.44503 15.1779 12.703 8.22353 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.32829 6.49786 9.28746 5.95728 12.6438 5.80433 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 8.32829 8.43154 13.0583 5.95728 12.6438 6.8285 numMergedOcc 0
8 mol 220 unq 0 iso 0 dist 9.85951 9.49722 5.21956 13.6133 9.85857 5.91133 numMergedOcc 0
9 mol 228 unq 0 iso 0 dist 9.4597 4.55699 8.6798 9.96075 17.94 9.91303 numMergedOcc 0
10 mol 228 unq 1 iso 0 dist 9.4597 8.10816 5.37846 15.9067 10.1622 7.81837 numMergedOcc 0
11 mol 228 unq 2 iso 0 dist 9.29603 7.95486 5.03713 15.904 9.95811 7.97746 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.53973 9.22306 9.11967 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 9.22306 9.11967 4.62998 8.53973 7.30618 8.40198 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.53973 9.22306 9.11967 numMergedOcc 0
15 mol 288 unq 1 iso 0 dist 9.22306 9.11967 4.62998 8.53973 7.30618 8.40198 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 7.30618 8.40198 4.62998 8.53973 9.22306 9.11967 numMergedOcc 0
17 mol 289 unq 1 iso 0 dist 9.22306 9.11967 4.62998 8.53973 7.30618 8.40198 numMergedOcc 0
18 mol 293 unq 0 iso 0 dist 8.78835 5.88449 4.74164 5.85599 11.0302 7.44889 numMergedOcc 0
19 mol 293 unq 1 iso 0 dist 8.78835 5.88449 4.74164 7.34816 9.85736 5.50284 numMergedOcc 0
20 mol 293 unq 2 iso 0 dist 8.78835 7.2668 7.0683 6.78719 13.8439 8.93207 numMergedOcc 0
21 mol 293 unq 3 iso 0 dist 8.78835 7.2668 7.0683 7.34816 9.85736 8.88355 numMergedOcc 0
