0 mol 7 unq 0 iso 0 dist 6.8464 11.4481 7.88043 14.6456 12.2708 9.55056 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.8464 11.4481 7.88043 8.77133 6.06176 7.45262 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 6.8464 13.9708 8.80762 14.6456 12.2708 7.57354 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 6.8464 13.9708 8.80762 8.77133 6.06176 6.96586 numMergedOcc 0
4 mol 8 unq 0 iso 0 dist 5.68648 9.55219 6.82379 14.8815 13.7792 8.94096 numMergedOcc 0
5 mol 8 unq 1 iso 0 dist 5.68648 9.55219 6.82379 18.417 15.4959 9.07858 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 6.36439 8.41682 7.72144 13.3446 13.9336 9.47362 numMergedOcc 0
7 mol 154 unq 1 iso 0 dist 6.36439 8.41682 7.72144 10.3914 6.53652 6.28417 numMergedOcc 0
8 mol 178 unq 0 iso 0 dist 9.63185 6.80181 4.92088 11.873 5.25267 5.98771 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 7.04524 4.52076 7.62942 7.87044 6.08211 9.79691 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 7.51951 6.95682 5.60393 11.6537 6.23291 5.42696 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 9.92165 13.4719 6.38157 15.621 6.67959 5.10114 numMergedOcc 0
12 mol 227 unq 0 iso 0 dist 8.27093 5.86596 8.38865 13.8963 9.60993 9.20589 numMergedOcc 0
13 mol 227 unq 1 iso 0 dist 8.27093 5.86596 8.38865 12.8148 13.3557 7.89801 numMergedOcc 0
14 mol 227 unq 2 iso 0 dist 9.02226 5.86596 5.4694 13.8963 5.34702 9.20589 numMergedOcc 0
15 mol 227 unq 3 iso 0 dist 9.02226 5.86596 5.4694 12.8148 8.8709 7.89801 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 8.6771 6.60696 6.66971 12.5472 13.0842 9.42618 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 9.58767 6.60696 6.4398 12.5472 15.3074 9.42618 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 7.00833 7.43942 8.60026 10.1364 5.22253 9.24121 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 9.4493 6.47044 5.23193 13.3084 7.30164 9.96468 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 9.4493 6.47044 5.23193 9.96388 8.36249 9.59817 numMergedOcc 0
