0 mol 0 unq 0 iso 0 dist 9.92758 5.55156 7.88507 7.1599 14.7993 7.15528 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.25201 6.22892 4.83427 7.15287 11.158 8.41585 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 8.88058 8.91266 5.49061 4.15151 6.89209 6.38364 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 9.25054 8.18518 12.0578 14.1404 20.3197 8.4674 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 9.25054 8.18518 12.0578 6.57145 13.8314 4.54938 numMergedOcc 0
5 mol 19 unq 2 iso 0 dist 9.25054 8.18518 12.0578 6.01189 13.7212 7.82074 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 9.34802 5.87895 7.53308 5.75653 13.5955 7.36323 numMergedOcc 0
7 mol 51 unq 0 iso 0 dist 9.70414 9.06397 5.82783 12.8917 10.5944 9.0709 numMergedOcc 0
8 mol 64 unq 0 iso 0 dist 8.25999 8.66921 7.66905 10.8918 15.9093 9.67592 numMergedOcc 0
9 mol 66 unq 0 iso 0 dist 9.0201 8.31793 6.68547 5.95767 12.6066 8.96624 numMergedOcc 0
10 mol 88 unq 0 iso 0 dist 8.30943 7.76275 6.77337 13.1838 15.9319 9.36773 numMergedOcc 0
11 mol 88 unq 1 iso 0 dist 8.30943 7.76275 6.77337 12.6939 13.6517 8.31336 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 9.86701 7.44784 8.37618 7.64822 9.93482 7.30858 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 9.86701 9.56867 7.12329 9.97256 12.5786 6.11741 numMergedOcc 0
14 mol 115 unq 2 iso 0 dist 9.86701 9.56867 7.12329 7.64822 9.93482 7.88312 numMergedOcc 0
15 mol 115 unq 3 iso 0 dist 8.86521 8.93552 5.24229 6.07331 6.04412 4.99221 numMergedOcc 0
16 mol 115 unq 4 iso 0 dist 8.86521 8.35604 10.7649 5.3967 12.0631 5.11551 numMergedOcc 0
17 mol 115 unq 5 iso 0 dist 8.86521 8.35604 10.7649 11.9798 17.447 7.11972 numMergedOcc 0
18 mol 125 unq 0 iso 0 dist 9.07195 9.63302 8.96999 6.06241 12.9988 8.62381 numMergedOcc 0
19 mol 125 unq 1 iso 0 dist 9.67137 9.63302 5.14495 6.06241 6.03557 8.62381 numMergedOcc 0
20 mol 130 unq 0 iso 0 dist 7.77423 9.05626 9.86628 7.09664 13.6645 8.70949 numMergedOcc 0
21 mol 188 unq 0 iso 0 dist 8.88948 7.63268 8.2743 7.63236 14.6088 9.96154 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 9.40687 9.40003 5.68711 16.5528 13.6328 9.65138 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 9.40687 9.40003 5.68711 9.11345 11.6154 7.14453 numMergedOcc 0
24 mol 214 unq 2 iso 0 dist 9.40687 9.40003 5.68711 16.922 11.5105 8.85478 numMergedOcc 0
25 mol 222 unq 0 iso 0 dist 6.19798 7.27481 5.01062 5.68063 8.7419 6.00706 numMergedOcc 0
26 mol 222 unq 1 iso 0 dist 6.19798 7.27481 5.01062 5.90074 8.5834 7.54212 numMergedOcc 0
27 mol 224 unq 0 iso 0 dist 8.27538 4.79841 5.25583 11.4653 13.0296 8.95269 numMergedOcc 0
28 mol 232 unq 0 iso 0 dist 9.32977 7.47238 6.64614 10.134 13.6896 8.27212 numMergedOcc 0
29 mol 239 unq 0 iso 0 dist 9.50474 9.27989 14.3464 12.1502 12.8429 6.16342 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 6.08059 6.21831 5.55557 6.11218 8.30175 9.10818 numMergedOcc 0
31 mol 276 unq 0 iso 0 dist 7.76689 5.30976 6.33662 7.38126 13.9936 9.8993 numMergedOcc 0
32 mol 276 unq 1 iso 0 dist 7.76689 5.30976 6.33662 6.39319 8.79189 6.87396 numMergedOcc 0
33 mol 276 unq 2 iso 0 dist 7.07283 5.30976 9.58401 7.38126 12.5562 9.8993 numMergedOcc 0
34 mol 276 unq 3 iso 0 dist 7.07283 5.30976 9.58401 6.39319 13.4249 6.87396 numMergedOcc 0
35 mol 279 unq 0 iso 0 dist 8.06324 5.17586 5.31331 5.9229 12.6214 9.70696 numMergedOcc 0
