0 mol 1 unq 0 iso 0 dist 6.36522 6.35771 10.0096 9.43252 15.0965 8.26708 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.36522 6.35771 10.0096 10.7006 15.7654 6.09918 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.74854 7.70793 15.2805 14.4127 20.5446 6.82379 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 9.74854 7.70793 15.2805 12.428 20.8335 6.24978 numMergedOcc 0
4 mol 8 unq 2 iso 0 dist 9.74854 7.70793 15.2805 14.2248 23.6586 9.66439 numMergedOcc 0
5 mol 8 unq 3 iso 0 dist 9.74854 7.70793 15.2805 8.93161 18.1145 7.3915 numMergedOcc 0
6 mol 14 unq 0 iso 0 dist 4.78509 7.91637 9.17332 4.52143 9.28046 9.58855 numMergedOcc 0
7 mol 14 unq 1 iso 0 dist 8.87679 7.91637 9.3765 4.52143 9.31271 9.58855 numMergedOcc 0
8 mol 25 unq 0 iso 0 dist 9.67955 6.98291 12.5224 6.32132 12.4066 6.6492 numMergedOcc 0
9 mol 28 unq 0 iso 0 dist 6.09309 6.69917 6.02451 5.66714 10.0528 7.28416 numMergedOcc 0
10 mol 43 unq 0 iso 0 dist 7.0835 9.32155 8.00981 7.23774 10.6262 8.44903 numMergedOcc 0
11 mol 44 unq 0 iso 0 dist 9.12845 8.2444 10.3047 14.7948 15.5268 7.52117 numMergedOcc 0
12 mol 56 unq 0 iso 0 dist 8.65949 8.58057 8.70109 9.16445 10.2288 6.77886 numMergedOcc 0
13 mol 56 unq 1 iso 0 dist 4.76164 8.58057 6.5705 9.16445 8.96238 6.77886 numMergedOcc 0
14 mol 75 unq 0 iso 0 dist 9.37955 7.4765 11.0316 6.42739 14.1795 7.9233 numMergedOcc 0
15 mol 75 unq 1 iso 0 dist 9.16165 5.86585 11.0316 6.15143 14.1795 7.9233 numMergedOcc 0
16 mol 98 unq 0 iso 0 dist 6.68748 7.56041 7.63357 12.1948 13.5014 5.88354 numMergedOcc 0
17 mol 98 unq 1 iso 0 dist 6.68748 7.56041 7.63357 13.2435 14.6204 7.89665 numMergedOcc 0
18 mol 98 unq 2 iso 0 dist 6.68748 7.56041 7.63357 5.62353 10.0471 5.39354 numMergedOcc 0
19 mol 98 unq 3 iso 0 dist 6.68748 7.56041 7.63357 7.42934 10.465 5.74854 numMergedOcc 0
20 mol 98 unq 4 iso 0 dist 6.68748 7.56041 7.63357 8.99607 11.3239 8.76566 numMergedOcc 0
21 mol 98 unq 5 iso 0 dist 6.68748 7.56041 7.63357 5.36136 6.26542 8.8368 numMergedOcc 0
22 mol 112 unq 0 iso 0 dist 8.37011 5.82495 9.2948 5.43987 13.3796 7.23962 numMergedOcc 0
23 mol 112 unq 1 iso 0 dist 8.37011 5.82495 9.2948 11.3454 17.7917 9.00067 numMergedOcc 0
24 mol 112 unq 2 iso 0 dist 8.37011 5.82495 9.2948 14.3588 18.6762 9.89499 numMergedOcc 0
25 mol 112 unq 3 iso 0 dist 8.37011 5.82495 9.2948 9.7695 14.5054 7.30204 numMergedOcc 0
26 mol 141 unq 0 iso 0 dist 5.77703 6.78772 7.97183 7.862 7.34465 6.69515 numMergedOcc 0
27 mol 141 unq 1 iso 0 dist 5.77703 6.78772 7.97183 5.64577 9.47675 7.86572 numMergedOcc 0
28 mol 148 unq 0 iso 0 dist 6.18528 9.14135 12.127 9.14127 14.8137 9.02318 numMergedOcc 0
29 mol 148 unq 1 iso 0 dist 6.18528 9.14135 12.127 14.7238 19.8565 9.74542 numMergedOcc 0
30 mol 148 unq 2 iso 0 dist 6.18528 9.14135 12.127 11.3515 14.6724 7.97543 numMergedOcc 0
31 mol 150 unq 0 iso 0 dist 6.13554 9.12067 12.1375 14.7649 19.8733 9.6606 numMergedOcc 0
32 mol 150 unq 1 iso 0 dist 6.13554 9.12067 12.1375 11.4349 14.7418 7.85526 numMergedOcc 0
33 mol 150 unq 2 iso 0 dist 6.13554 9.12067 12.1375 9.10666 14.7263 8.94552 numMergedOcc 0
34 mol 186 unq 0 iso 0 dist 7.49656 6.84316 5.26443 5.64932 10.6149 7.28841 numMergedOcc 0
35 mol 203 unq 0 iso 0 dist 9.38519 5.79502 9.21315 4.57363 13.6417 8.72527 numMergedOcc 0
36 mol 238 unq 0 iso 0 dist 5.42362 6.52129 8.09178 5.65307 9.38753 5.52379 numMergedOcc 0
37 mol 261 unq 0 iso 0 dist 9.86439 9.39571 12.6696 6.42225 13.196 5.26434 numMergedOcc 0
38 mol 261 unq 1 iso 0 dist 9.86439 9.39571 12.6696 11.0363 18.9793 8.60026 numMergedOcc 0
