0 mol 56 unq 0 iso 0 dist 6.86162 6.60662 9.2898 11.3205 14.8094 6.80741 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 5.82829 5.44752 6.56212 11.9193 11.1377 6.48625 numMergedOcc 0
2 mol 89 unq 0 iso 0 dist 8.54514 5.73599 8.40422 7.61813 3.30729 9.58625 numMergedOcc 0
3 mol 89 unq 1 iso 0 dist 8.54514 7.8379 5.51831 7.61813 3.30729 6.36021 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 5.15951 7.41993 7.86666 15.3392 14.5244 8.21889 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 5.15951 13.345 9.77497 9.40638 6.54844 6.31633 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.25027 4.28997 7.22643 9.63478 12.9426 9.4473 numMergedOcc 0
7 mol 142 unq 0 iso 0 dist 9.64785 12.444 7.81207 15.9036 9.23267 7.57458 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.77567 5.29694 6.59889 6.53428 9.0696 8.89982 numMergedOcc 0
9 mol 220 unq 0 iso 0 dist 9.72819 9.58096 9.20104 12.6955 4.7404 8.39425 numMergedOcc 0
10 mol 220 unq 1 iso 0 dist 8.87401 6.94835 9.20104 9.09314 4.7404 8.39425 numMergedOcc 0
11 mol 220 unq 2 iso 0 dist 8.86035 7.36035 9.20104 9.03904 4.7404 8.39425 numMergedOcc 0
12 mol 220 unq 3 iso 0 dist 5.83372 7.36035 9.58404 9.03904 5.11711 8.39425 numMergedOcc 0
13 mol 220 unq 4 iso 0 dist 9.82471 10.4268 9.58404 13.4602 5.11711 8.39425 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 9.06892 10.0163 6.74196 17.56 15.1289 8.7347 numMergedOcc 0
15 mol 222 unq 1 iso 0 dist 8.54373 10.362 8.36842 16.5736 13.6078 8.7347 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 8.55819 10.5504 8.79428 18.936 12.65 9.79616 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 8.55819 12.7033 6.8692 17.3567 9.56183 9.29703 numMergedOcc 0
18 mol 257 unq 0 iso 0 dist 8.76085 9.4018 8.83833 10.1142 11.9011 5.36776 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 9.93282 5.69584 5.85442 9.98565 7.06301 7.93997 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 8.90555 5.69584 6.95511 9.98565 7.80863 7.93997 numMergedOcc 0
21 mol 259 unq 2 iso 0 dist 6.93417 9.13047 9.07743 13.4783 9.90573 6.77279 numMergedOcc 0
22 mol 259 unq 3 iso 0 dist 6.93417 5.07898 7.66153 13.4783 9.90573 9.58006 numMergedOcc 0
