0 mol 8 unq 0 iso 0 dist 6.4754 7.06064 9.62879 11.9453 8.4069 8.96553 10.9476 10.6335 7.43529 7.3915 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.57999 7.35767 9.62879 4.92734 8.4069 8.96553 9.91124 10.6335 7.43529 7.3915 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.17086 5.90113 8.80331 10.615 8.13395 6.20293 8.33667 9.93832 9.06158 8.60739 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.124 13.4367 6.19304 10.1112 5.4148 9.96396 16.0036 8.73253 8.26458 7.04044 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.124 13.4367 6.19304 19.5696 13.3558 8.70481 24.6216 18.0011 14.8866 8.85586 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 8.124 13.4367 6.19304 19.5696 13.3558 8.70481 19.8548 12.0613 8.05119 7.11 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 8.16299 10.3774 8.70481 11.0108 14.9342 9.96396 9.9619 10.3244 8.26458 7.04044 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 8.16299 10.3774 8.70481 10.9082 13.3558 6.19304 9.9619 10.3244 8.26458 8.73253 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 8.27015 12.6626 8.70481 20.562 14.9342 9.96396 17.7342 10.3244 8.26458 7.04044 numMergedOcc 0
9 mol 73 unq 6 iso 0 dist 8.27015 12.6626 8.70481 17.327 13.3558 6.19304 17.7342 10.3244 8.26458 8.73253 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 6.56728 11.609 7.47541 13.2962 6.9948 7.97049 17.0217 11.2808 6.37974 7.1589 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 6.56728 13.5384 7.66905 17.1838 10.7229 7.95579 17.0217 11.2808 5.08358 8.00777 numMergedOcc 0
12 mol 85 unq 2 iso 0 dist 6.56728 13.5384 7.66905 13.2962 6.9948 6.19965 17.0217 11.2808 5.08358 7.1589 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 7.51061 5.29855 7.34473 11.8872 7 8.58044 10.5968 10.3189 5.54205 8.89913 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 8.97043 11.8721 9.33865 12.9647 7.69052 5.83991 11.9046 10.9734 6.4497 5.72642 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 8.97043 5.19652 6.11741 12.9647 7.69052 7.88312 11.9046 10.9734 7.3094 5.72642 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 9.33945 12.3624 8.40312 14.2573 5.55373 7.12972 11.8905 8.86329 5.89022 8.71039 numMergedOcc 0
17 mol 131 unq 1 iso 0 dist 9.33945 12.3624 8.40312 14.2573 5.55373 7.12972 18.8056 11.4206 9.32969 6.92648 numMergedOcc 0
18 mol 131 unq 2 iso 0 dist 9.33945 12.3624 8.40312 17.4482 10.7062 6.85062 18.8056 11.4206 9.32969 9.29384 numMergedOcc 0
19 mol 131 unq 3 iso 0 dist 8.99949 11.3502 6.85062 18.591 10.7062 8.40312 16.1065 11.6142 5.89022 8.86329 numMergedOcc 0
20 mol 131 unq 4 iso 0 dist 8.99949 11.3502 6.85062 15.0798 6.63273 7.12972 16.1065 11.6142 5.89022 8.71039 numMergedOcc 0
21 mol 131 unq 5 iso 0 dist 8.99949 11.3502 6.85062 15.0798 6.63273 7.12972 14.8405 9.29384 9.32969 6.92648 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 7.27598 6.50005 6.37586 12.3933 5.49782 8.94367 15.3258 10.873 9.4027 8.20836 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 7.27598 6.50005 6.37586 5.57904 5.00817 6.49416 5.98568 10.1537 8.46636 5.53031 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 7.27598 12.0971 9.71307 12.3933 5.49782 9.86662 15.3258 10.873 5.12325 8.20836 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 5.57904 6.50005 6.49416 12.3933 8.80819 8.94367 15.3258 13.846 9.4027 8.20836 numMergedOcc 0
26 mol 142 unq 0 iso 0 dist 9.14908 6.3846 5.31024 10.9228 5.32922 9.2313 12.3976 12.432 12.6057 9.17106 numMergedOcc 0
27 mol 142 unq 1 iso 0 dist 9.14908 4.39297 7.26382 10.9228 5.32922 7.73169 12.3976 12.432 8.38032 9.17106 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 5.16813 11.0854 8.87694 14.4578 9.50685 9.09754 19.7486 15.9107 9.97575 8.64409 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 6.15806 10.6362 7.26832 12.9169 7.38516 6.03031 6.37333 5.60393 5.28092 8.44861 numMergedOcc 0
30 mol 222 unq 0 iso 0 dist 8.5834 5.01062 7.54212 8.7419 6.8425 6.00706 7.26742 12.5287 6.42798 7.862 numMergedOcc 0
31 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 12.0857 5.22356 8.65997 11.2986 8.38865 11.0628 5.4694 numMergedOcc 0
32 mol 227 unq 1 iso 0 dist 9.60159 7.51316 7.22101 14.7829 12.4689 7.55216 16.2 16.0894 10.6244 5.87815 numMergedOcc 0
33 mol 227 unq 2 iso 0 dist 7.71761 5.841 7.55216 12.9898 12.4689 7.22101 15.8833 16.9219 11.0628 8.38865 numMergedOcc 0
34 mol 227 unq 3 iso 0 dist 7.71761 5.841 7.55216 14.1659 12.9332 8.65997 15.8833 16.9219 11.0628 5.4694 numMergedOcc 0
35 mol 252 unq 0 iso 0 dist 7.93609 9.76823 8.33025 16.2688 14.9102 7.19638 10.5336 12.322 5.25252 6.86945 numMergedOcc 0
36 mol 253 unq 0 iso 0 dist 7.26981 10.8952 8.31064 13.2486 8.02948 6.73034 17.2733 13.1441 6.89124 9.66465 numMergedOcc 0
37 mol 253 unq 1 iso 0 dist 9.02643 8.25257 8.31064 8.68368 8.02948 6.73034 14.7937 13.1441 6.89124 9.66465 numMergedOcc 0
38 mol 258 unq 0 iso 0 dist 8.21585 5.13233 6.42289 10.7821 7.26417 6.60405 12.2193 7.99477 7.42673 6.70815 numMergedOcc 0
