0 mol 1 unq 0 iso 0 dist 6.41817 7.42008 9.76602 11.6758 7.46399 9.77112 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.4868 7.55819 8.54314 7.52834 8.21384 6.15359 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 5.80623 5.21735 5.66743 8.21453 7.18409 3.9551 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 5.80623 5.21735 5.66743 6.8422 6.21163 5.10645 numMergedOcc 0
4 mol 27 unq 2 iso 0 dist 5.80623 4.66619 7.42669 8.21453 7.18409 10.978 numMergedOcc 0
5 mol 27 unq 3 iso 0 dist 5.80623 4.66619 7.42669 6.8422 6.21163 5.00553 numMergedOcc 0
6 mol 27 unq 4 iso 0 dist 7.24775 12.4614 5.66743 14.1996 7.18409 3.9551 numMergedOcc 0
7 mol 27 unq 5 iso 0 dist 7.24775 12.4614 5.66743 10.2292 6.21163 5.10645 numMergedOcc 0
8 mol 27 unq 6 iso 0 dist 7.24775 10.6589 7.42669 14.1996 7.18409 10.978 numMergedOcc 0
9 mol 27 unq 7 iso 0 dist 7.24775 10.6589 7.42669 10.2292 6.21163 5.00553 numMergedOcc 0
10 mol 46 unq 0 iso 0 dist 6.19084 5.79552 9.27409 9.89704 9.81193 5.73909 numMergedOcc 0
11 mol 54 unq 0 iso 0 dist 5.0478 8.88887 4.38047 10.6593 5.7405 4.94741 numMergedOcc 0
12 mol 56 unq 0 iso 0 dist 7.52378 8.48311 8.85981 11.0121 9.78973 6.07317 numMergedOcc 0
13 mol 68 unq 0 iso 0 dist 7.3797 6.55798 7.07989 11.3174 6.34966 7.13073 numMergedOcc 0
14 mol 68 unq 1 iso 0 dist 7.3797 6.24521 9.77272 11.3174 6.34966 13.7884 numMergedOcc 0
15 mol 83 unq 0 iso 0 dist 9.42195 5.8771 9.97781 8.63955 9.50228 12.1829 numMergedOcc 0
16 mol 100 unq 0 iso 0 dist 8.22984 14.6602 9.16592 11.2351 9.95103 14.9354 numMergedOcc 0
17 mol 100 unq 1 iso 0 dist 6.6157 10.6262 9.16592 8.46662 9.95103 14.9354 numMergedOcc 0
18 mol 100 unq 2 iso 0 dist 7.37771 6.15808 9.16592 10.5049 9.95103 14.9354 numMergedOcc 0
19 mol 112 unq 0 iso 0 dist 6.73172 6.50047 5.42828 12.9793 9.69961 8.86411 numMergedOcc 0
20 mol 116 unq 0 iso 0 dist 7.85045 12.6384 7.6005 9.09348 6.63731 5.17486 numMergedOcc 0
21 mol 116 unq 1 iso 0 dist 7.85045 14.5749 8.7583 9.09348 6.63731 6.28627 numMergedOcc 0
22 mol 120 unq 0 iso 0 dist 8.41086 11.0066 8.73484 6.56678 9.37051 13.5076 numMergedOcc 0
23 mol 120 unq 1 iso 0 dist 7.41599 8.42157 8.73484 8.15855 9.37051 13.5076 numMergedOcc 0
24 mol 167 unq 0 iso 0 dist 7.93807 10.33 9.14629 10.8805 9.69399 7.8548 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 9.84034 8.01459 8.7085 12.1549 7.43301 7.33956 numMergedOcc 0
26 mol 214 unq 1 iso 0 dist 8.07237 10.0122 8.7085 9.59563 7.43301 7.33956 numMergedOcc 0
27 mol 214 unq 2 iso 0 dist 8.95218 9.50284 8.7085 6.52672 7.43301 7.33956 numMergedOcc 0
28 mol 226 unq 0 iso 0 dist 9.20651 16.0868 7.04477 18.1288 9.61639 5.02367 numMergedOcc 0
29 mol 249 unq 0 iso 0 dist 9.68308 13.6906 6.58109 13.3058 4.68783 5.34664 numMergedOcc 0
30 mol 253 unq 0 iso 0 dist 7.06589 4.58695 9.69704 14.3975 9.6479 17.557 numMergedOcc 0
31 mol 253 unq 1 iso 0 dist 8.70383 11.088 9.69704 12.7693 9.6479 17.557 numMergedOcc 0
32 mol 256 unq 0 iso 0 dist 8.95444 5.89194 5.66817 9.56036 7.40057 4.29865 numMergedOcc 0
33 mol 256 unq 1 iso 0 dist 7.53508 11.8934 5.66817 13.694 7.40057 4.29865 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 9.52718 7.88871 7.76945 15.6724 8.9316 9.43452 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 9.52718 7.88871 7.76945 15.6724 8.9316 9.43452 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 9.52718 7.88871 7.76945 15.6724 8.9316 9.43452 numMergedOcc 0
