0 mol 10 unq 0 iso 0 dist 6.94273 4.71606 9.38807 8.74239 9.17211 6.70642 numMergedOcc 0
1 mol 10 unq 0 iso 1 dist 6.94273 8.74239 9.17211 4.71606 9.38807 6.70642 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 5.55376 9.41089 6.55815 4.7721 7.09121 7.04792 numMergedOcc 0
3 mol 30 unq 0 iso 1 dist 5.55376 4.7721 7.09121 9.41089 6.55815 7.04792 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 9.16411 13.7449 7.03307 10.2782 7.25707 5.25016 numMergedOcc 0
5 mol 44 unq 0 iso 1 dist 9.16411 10.2782 7.25707 13.7449 7.03307 5.25016 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 6.40964 5.04277 8.57827 6.77665 7.94453 11.7781 numMergedOcc 0
7 mol 92 unq 0 iso 1 dist 6.40964 6.77665 7.94453 5.04277 8.57827 11.7781 numMergedOcc 0
8 mol 105 unq 0 iso 0 dist 8.66946 8.62526 7.71923 9.71724 9.87821 4.32675 numMergedOcc 0
9 mol 105 unq 0 iso 1 dist 8.66946 9.71724 9.87821 8.62526 7.71923 4.32675 numMergedOcc 0
10 mol 105 unq 1 iso 0 dist 8.66946 8.62526 7.71923 11.7138 7.09806 6.37217 numMergedOcc 0
11 mol 105 unq 1 iso 1 dist 8.66946 11.7138 7.09806 8.62526 7.71923 6.37217 numMergedOcc 0
12 mol 105 unq 1 iso 0 dist 8.66946 9.71724 9.87821 11.7138 7.09806 5.73435 numMergedOcc 0
13 mol 105 unq 1 iso 1 dist 8.66946 11.7138 7.09806 9.71724 9.87821 5.73435 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.02258 5.63251 4.46777 12.1023 6.94988 6.51325 numMergedOcc 0
15 mol 141 unq 0 iso 1 dist 8.02258 12.1023 6.94988 5.63251 4.46777 6.51325 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 6.64084 4.57581 6.76055 11.2833 9.36343 6.97949 numMergedOcc 0
17 mol 158 unq 0 iso 1 dist 6.64084 11.2833 9.36343 4.57581 6.76055 6.97949 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 8.6792 10.301 7.14263 4.05981 8.57005 10.0763 numMergedOcc 0
19 mol 162 unq 0 iso 1 dist 8.6792 4.05981 8.57005 10.301 7.14263 10.0763 numMergedOcc 0
20 mol 175 unq 0 iso 0 dist 9.02096 8.56805 8.05247 11.8728 9.71028 6.91059 numMergedOcc 0
21 mol 175 unq 0 iso 1 dist 9.02096 11.8728 9.71028 8.56805 8.05247 6.91059 numMergedOcc 0
22 mol 210 unq 0 iso 0 dist 5.6524 4.36112 5.57779 10.7545 7.05649 7.33239 numMergedOcc 0
23 mol 210 unq 0 iso 1 dist 5.6524 10.7545 7.05649 4.36112 5.57779 7.33239 numMergedOcc 0
24 mol 210 unq 1 iso 0 dist 5.6524 4.36112 5.57779 10.4519 6.78579 8.67862 numMergedOcc 0
25 mol 210 unq 1 iso 1 dist 5.6524 10.4519 6.78579 4.36112 5.57779 8.67862 numMergedOcc 0
26 mol 210 unq 1 iso 0 dist 5.6524 10.7545 7.05649 10.4519 6.78579 5.72053 numMergedOcc 0
27 mol 210 unq 1 iso 1 dist 5.6524 10.4519 6.78579 10.7545 7.05649 5.72053 numMergedOcc 0
28 mol 222 unq 0 iso 0 dist 5.98014 10.3035 9.08955 13.4152 8.88664 6.85131 numMergedOcc 0
29 mol 222 unq 0 iso 1 dist 5.98014 13.4152 8.88664 10.3035 9.08955 6.85131 numMergedOcc 0
30 mol 222 unq 1 iso 0 dist 5.98014 10.3035 9.08955 11.5963 7.16819 6.76935 numMergedOcc 0
31 mol 222 unq 1 iso 1 dist 5.98014 11.5963 7.16819 10.3035 9.08955 6.76935 numMergedOcc 0
32 mol 222 unq 1 iso 0 dist 5.98014 13.4152 8.88664 11.5963 7.16819 4.19322 numMergedOcc 0
33 mol 222 unq 1 iso 1 dist 5.98014 11.5963 7.16819 13.4152 8.88664 4.19322 numMergedOcc 0
34 mol 230 unq 0 iso 0 dist 6.86851 11.277 8.34416 9.16476 6.34832 5.10781 numMergedOcc 0
35 mol 230 unq 0 iso 1 dist 6.86851 9.16476 6.34832 11.277 8.34416 5.10781 numMergedOcc 0
36 mol 230 unq 1 iso 0 dist 9.88392 6.41577 8.34416 10.5257 6.34832 5.10781 numMergedOcc 0
37 mol 230 unq 1 iso 1 dist 9.88392 10.5257 6.34832 6.41577 8.34416 5.10781 numMergedOcc 0
38 mol 232 unq 0 iso 0 dist 7.42469 4.06349 7.38566 9.4234 8.28466 5.77703 numMergedOcc 0
39 mol 232 unq 0 iso 1 dist 7.42469 9.4234 8.28466 4.06349 7.38566 5.77703 numMergedOcc 0
