0 mol 1 unq 0 iso 0 dist 6.36522 6.35771 10.0096 7.52834 9.62879 9.60596 9.43252 15.0965 8.26708 9.01148 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.36522 6.35771 10.0096 7.52834 9.62879 9.60596 10.7006 15.7654 6.09918 12.4943 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.74854 7.70793 15.2805 4.35292 9.83409 11.3263 14.4127 20.5446 6.82379 17.8802 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 9.74854 7.70793 15.2805 4.35292 9.83409 11.3263 12.428 20.8335 6.24978 14.9175 numMergedOcc 0
4 mol 8 unq 2 iso 0 dist 9.74854 7.70793 15.2805 4.35292 9.83409 11.3263 14.2248 23.6586 9.66439 16.4164 numMergedOcc 0
5 mol 8 unq 3 iso 0 dist 9.74854 7.70793 15.2805 4.35292 9.83409 11.3263 8.93161 18.1145 7.3915 12.0228 numMergedOcc 0
6 mol 14 unq 0 iso 0 dist 8.87679 7.91637 9.3765 15.588 8.79533 17.4819 4.52143 9.31271 9.58855 16.5607 numMergedOcc 0
7 mol 25 unq 0 iso 0 dist 9.67955 6.98291 12.5224 8.22296 9.88453 10.3004 6.32132 12.4066 6.6492 13.7275 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 7.0835 9.32155 8.00981 8.29737 7.72069 14.9527 7.23774 10.6262 8.44903 13.8309 numMergedOcc 0
9 mol 43 unq 1 iso 0 dist 7.0835 9.32155 8.00981 5.15224 6.61704 12.1913 7.23774 10.6262 8.44903 12.1132 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 6.68748 7.56041 7.63357 7.76377 8.26758 12.9581 12.1948 13.5014 5.88354 18.2133 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 6.68748 7.56041 7.63357 7.76377 8.26758 12.9581 13.2435 14.6204 7.89665 20.2123 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 6.68748 7.56041 7.63357 7.76377 8.26758 12.9581 5.62353 10.0471 5.39354 12.7661 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 6.68748 7.56041 7.63357 7.76377 8.26758 12.9581 7.42934 10.465 5.74854 11.7472 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 6.68748 7.56041 7.63357 7.76377 8.26758 12.9581 8.99607 11.3239 8.76566 16.4194 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 6.68748 7.56041 7.63357 7.76377 8.26758 12.9581 5.36136 6.26542 8.8368 10.844 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 5.77703 6.78772 7.97183 5.49686 8.51265 11.4006 7.862 7.34465 6.69515 13.1327 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 5.77703 6.78772 7.97183 5.49686 8.51265 11.4006 5.64577 9.47675 7.86572 10.4653 numMergedOcc 0
18 mol 148 unq 0 iso 0 dist 6.18528 9.14135 12.127 4.23703 5.34451 12.3584 9.14127 14.8137 9.02318 11.4865 numMergedOcc 0
19 mol 148 unq 1 iso 0 dist 6.18528 9.14135 12.127 4.23703 5.34451 12.3584 14.7238 19.8565 9.74542 17.6092 numMergedOcc 0
20 mol 148 unq 2 iso 0 dist 6.18528 9.14135 12.127 4.23703 5.34451 12.3584 11.3515 14.6724 7.97543 12.5717 numMergedOcc 0
21 mol 148 unq 3 iso 0 dist 6.18528 9.14135 12.127 6.5387 9.74966 5.29515 9.14127 14.8137 9.02318 7.12546 numMergedOcc 0
22 mol 148 unq 4 iso 0 dist 6.18528 9.14135 12.127 6.5387 9.74966 5.29515 14.7238 19.8565 9.74542 10.7866 numMergedOcc 0
23 mol 148 unq 5 iso 0 dist 6.18528 9.14135 12.127 6.5387 9.74966 5.29515 11.3515 14.6724 7.97543 5.2593 numMergedOcc 0
24 mol 150 unq 0 iso 0 dist 6.13554 9.12067 12.1375 4.0525 6.6175 12.677 14.7649 19.8733 9.6606 17.2642 numMergedOcc 0
25 mol 150 unq 1 iso 0 dist 6.13554 9.12067 12.1375 4.0525 6.6175 12.677 11.4349 14.7418 7.85526 12.9958 numMergedOcc 0
26 mol 150 unq 2 iso 0 dist 6.13554 9.12067 12.1375 4.0525 6.6175 12.677 9.10666 14.7263 8.94552 10.7409 numMergedOcc 0
27 mol 150 unq 3 iso 0 dist 6.13554 9.12067 12.1375 6.67151 9.87914 5.16917 14.7649 19.8733 9.6606 10.734 numMergedOcc 0
28 mol 150 unq 4 iso 0 dist 6.13554 9.12067 12.1375 6.67151 9.87914 5.16917 11.4349 14.7418 7.85526 5.1918 numMergedOcc 0
29 mol 150 unq 5 iso 0 dist 6.13554 9.12067 12.1375 6.67151 9.87914 5.16917 9.10666 14.7263 8.94552 7.02896 numMergedOcc 0
30 mol 261 unq 0 iso 0 dist 9.86439 9.39571 12.6696 17.8598 9.64886 20.4701 6.42225 13.196 5.26434 20.5425 numMergedOcc 0
31 mol 261 unq 1 iso 0 dist 9.86439 9.39571 12.6696 17.8598 9.64886 20.4701 11.0363 18.9793 8.60026 27.22 numMergedOcc 0
