0 mol 34 unq 0 iso 0 dist 8.87762 12.9926 7.18022 11.4813 4.71262 8.16494 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 8.21762 12.9926 6.24711 11.4813 4.28439 8.16494 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 5.40287 6.82279 8.66539 8.68096 3.73561 9.92438 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 5.40287 5.52874 5.38524 8.68096 3.73561 7.66055 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 5.6359 11.4221 9.69044 9.98104 5.68713 6.56664 numMergedOcc 0
5 mol 62 unq 1 iso 0 dist 5.6359 11.4221 9.69044 11.07 6.72919 7.99003 numMergedOcc 0
6 mol 62 unq 2 iso 0 dist 5.6359 11.4221 9.69044 5.80956 3.78856 9.96382 numMergedOcc 0
7 mol 62 unq 3 iso 0 dist 5.6359 4.05764 6.9103 9.98104 5.68713 9.58156 numMergedOcc 0
8 mol 62 unq 4 iso 0 dist 5.6359 4.05764 6.9103 5.80956 3.78856 7.59416 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 9.54537 14.437 7.51139 15.1484 5.7326 8.25679 numMergedOcc 0
10 mol 89 unq 0 iso 0 dist 8.54514 7.8379 5.51831 11.7966 5.72671 5.25504 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 8.59002 6.7184 4.22363 7.91934 4.03471 6.5258 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 6.53198 13.9402 8.80934 13.5057 7.05148 8.29529 numMergedOcc 0
13 mol 146 unq 0 iso 0 dist 8.82192 7.05046 9.04757 8.64781 3.75935 7.24965 numMergedOcc 0
14 mol 243 unq 0 iso 0 dist 6.02146 11.8651 8.67156 11.0938 8.36019 8.69557 numMergedOcc 0
15 mol 243 unq 1 iso 0 dist 6.02146 11.8651 8.67156 10.5944 5.7044 4.89168 numMergedOcc 0
16 mol 257 unq 0 iso 0 dist 8.76085 9.4018 8.83833 11.247 3.84196 8.95261 numMergedOcc 0
17 mol 257 unq 1 iso 0 dist 8.76085 9.4018 8.83833 13.0928 5.95711 7.80336 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 6.93417 9.13047 9.07743 8.91236 5.13757 5.29682 numMergedOcc 0
19 mol 259 unq 1 iso 0 dist 6.93417 5.07898 7.66153 8.91236 5.13757 6.20344 numMergedOcc 0
