0 mol 18 unq 0 iso 0 dist 8.2056 5.34733 6.39307 8.51213 4.25207 5.65084 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.26381 14.9746 8.27137 11.2792 5.59268 4.79873 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 8.61468 7.18645 7.32064 9.45835 7.17843 6.85523 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 8.61468 7.18645 7.32064 10.3301 13.1649 8.65848 numMergedOcc 0
4 mol 78 unq 2 iso 0 dist 8.61468 12.613 5.85007 9.45835 7.17843 5.77326 numMergedOcc 0
5 mol 78 unq 3 iso 0 dist 6.27186 7.18645 4.62314 9.45835 4.4651 6.85523 numMergedOcc 0
6 mol 78 unq 4 iso 0 dist 6.27186 7.18645 4.62314 10.3301 9.31889 8.65848 numMergedOcc 0
7 mol 78 unq 5 iso 0 dist 6.27186 12.613 6.35234 9.45835 4.4651 5.77326 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 8.68497 9.65919 5.73799 11.3066 5.65355 7.07095 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 6.02644 8.96364 9.43496 12.8485 9.56471 7.06939 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 8.28452 7.05148 6.12348 8.29529 14.0364 8.80934 numMergedOcc 0
11 mol 113 unq 1 iso 0 dist 8.44004 13.2701 6.12348 18.9382 14.0364 8.80934 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 8.21127 10.4345 6.31773 12.9567 5.28901 6.04595 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 6.12404 3.82475 8.42219 5.22628 5.24961 6.39384 numMergedOcc 0
14 mol 115 unq 2 iso 0 dist 6.12404 3.82475 8.42219 11.2519 11.8122 9.42082 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 8.87505 11.1633 5.82945 12.4719 3.96103 6.93139 numMergedOcc 0
16 mol 146 unq 0 iso 0 dist 5.3184 3.75935 6.93154 7.24965 5.44003 9.04757 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.21404 8.96906 7.25438 15.7985 9.20928 8.14831 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 9.49046 11.3928 7.1229 11.3476 6.52848 8.51625 numMergedOcc 0
19 mol 233 unq 1 iso 0 dist 7.24533 3.67394 7.1229 10.553 6.52848 8.51625 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 6.84088 3.45727 7.63381 6.92721 9.86326 6.73665 numMergedOcc 0
21 mol 239 unq 1 iso 0 dist 6.84088 3.45727 7.63381 10.6009 5.82779 9.34438 numMergedOcc 0
22 mol 239 unq 2 iso 0 dist 6.84088 3.45727 7.63381 12.0468 13.5224 9.35949 numMergedOcc 0
23 mol 270 unq 0 iso 0 dist 6.55866 3.8694 6.46935 7.05331 5.00269 9.31275 numMergedOcc 0
24 mol 270 unq 1 iso 0 dist 6.55866 5.76483 5.98384 7.05331 5.00269 8.56508 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 5.76223 4.0294 5.72473 10.7611 8.04474 7.20674 numMergedOcc 0
