0 mol 9 unq 0 iso 0 dist 5.2505 4.71717 6.36209 5.17163 6.46988 7.4861 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 4.7864 7.88793 7.92196 5.25639 7.99981 5.40507 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 9.27456 15.5947 7.54915 16.1058 8.97148 5.71795 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 4.83495 5.24518 4.32161 4.22408 7.09296 8.90926 numMergedOcc 0
4 mol 91 unq 1 iso 0 dist 4.83495 5.24518 4.32161 5.11651 6.28054 5.9979 numMergedOcc 0
5 mol 91 unq 2 iso 0 dist 5.11803 5.24518 7.34465 4.22408 6.51618 8.90926 numMergedOcc 0
6 mol 91 unq 3 iso 0 dist 5.11803 5.24518 7.34465 5.11651 8.77748 5.9979 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 9.13829 6.87017 5.94417 11.7838 8.48405 13.081 numMergedOcc 0
8 mol 120 unq 1 iso 0 dist 5.90276 5.23504 5.94417 9.34774 8.48405 13.081 numMergedOcc 0
9 mol 120 unq 2 iso 0 dist 8.565 13.9931 5.94417 6.20311 8.48405 13.081 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.18881 5.05068 6.48738 7.03121 6.58667 5.77447 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 9.35927 6.83365 6.48738 5.85377 6.58667 5.77447 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 9.19804 10.8705 9.58365 6.93656 7.18359 5.45801 numMergedOcc 0
13 mol 154 unq 1 iso 0 dist 9.19804 10.8705 9.58365 10.0808 7.66303 9.33286 numMergedOcc 0
14 mol 219 unq 0 iso 0 dist 8.15287 6.90398 6.65093 6.16486 6.30365 9.78352 numMergedOcc 0
15 mol 219 unq 1 iso 0 dist 8.15287 6.90398 6.65093 11.7676 5.47325 10.277 numMergedOcc 0
16 mol 219 unq 2 iso 0 dist 8.15287 15.4761 9.93514 6.16486 6.30365 10.7269 numMergedOcc 0
17 mol 219 unq 3 iso 0 dist 8.15287 15.4761 9.93514 11.7676 5.47325 10.2112 numMergedOcc 0
18 mol 219 unq 4 iso 0 dist 8.72341 14.8716 6.65093 11.6024 6.30365 9.78352 numMergedOcc 0
19 mol 219 unq 5 iso 0 dist 8.72341 14.8716 6.65093 6.19264 5.47325 10.277 numMergedOcc 0
20 mol 219 unq 6 iso 0 dist 8.72341 6.78678 9.93514 11.6024 6.30365 10.7269 numMergedOcc 0
21 mol 219 unq 7 iso 0 dist 8.72341 6.78678 9.93514 6.19264 5.47325 10.2112 numMergedOcc 0
22 mol 242 unq 0 iso 0 dist 8.75712 9.37076 8.90437 11.6891 7.96658 4.39465 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 7.81415 12.3631 5.7378 6.35551 7.8959 9.42281 numMergedOcc 0
24 mol 283 unq 1 iso 0 dist 7.81415 5.49773 7.15632 6.35551 7.8959 7.22633 numMergedOcc 0
