0 mol 28 unq 0 iso 0 dist 7.82759 12.7911 8.53424 18.4232 16.4255 9.2146 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 7.23371 6.75911 3.77542 9.98922 6.08836 5.4713 numMergedOcc 0
2 mol 63 unq 0 iso 0 dist 9.18651 7.17611 9.13228 14.8179 10.1907 8.78414 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 4.45433 5.80317 8.61143 6.90069 4.315 9.38837 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 4.45433 5.80317 8.61143 10.7475 9.00868 9.80913 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.60619 4.91617 4.15789 9.52098 4.69555 7.92114 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 7.60619 4.91617 4.15789 12.0256 6.49084 8.18375 numMergedOcc 0
7 mol 107 unq 0 iso 0 dist 9.4238 17.9309 8.88124 13.1742 5.88785 7.91251 numMergedOcc 0
8 mol 107 unq 1 iso 0 dist 9.4238 8.0395 8.19484 13.1742 5.88785 9.09262 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 9.22398 11.3635 6.21029 11.1383 7.30495 9.45013 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 8.0237 4.58282 6.55227 10.8476 6.51576 9.87354 numMergedOcc 0
11 mol 116 unq 1 iso 0 dist 7.70636 4.13866 6.55227 9.17843 3.43966 7.54274 numMergedOcc 0
12 mol 116 unq 2 iso 0 dist 6.82267 10.1108 6.55227 7.31364 3.43966 7.54274 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 7.382 7.67738 7.53342 12.9795 6.95147 8.49847 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 9.66898 5.30387 9.55626 9.26885 5.43825 6.68939 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 8.64187 9.83742 9.71831 17.2591 14.4808 9.02881 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 7.6142 3.64536 4.55853 11.2064 7.66826 9.53137 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 4.20369 5.76999 7.04263 10.8312 8.22506 8.51564 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 8.38399 12.0007 5.88958 9.26793 3.14843 4.27826 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 8.38399 15.0759 7.78121 9.26793 3.14843 5.82074 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 7.29668 10.326 4.68668 10.7645 3.66473 4.93516 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 7.29668 10.326 4.68668 10.7645 3.66473 4.93516 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 7.29668 10.326 4.68668 10.7645 3.66473 4.93516 numMergedOcc 0
