0 mol 26 unq 0 iso 0 dist 7.34549 4.76147 8.34347 6.42206 5.3315 6.88695 4.20567 10.8071 4.09495 8.6112 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.09068 6.30129 8.34347 10.1907 5.3315 6.88695 9.76672 10.8071 4.09495 8.6112 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.72289 5.93227 8.34347 9.66602 5.3315 6.88695 9.87081 10.8071 4.09495 8.6112 numMergedOcc 0
3 mol 51 unq 0 iso 0 dist 8.99612 10.2637 9.0709 14.2591 13.6102 7.12423 14.1481 18.8646 12.4834 9.66898 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.17862 15.821 7.27724 10.4065 5.33325 9.65047 10.3053 12.146 16.7208 8.36326 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 8.27456 9.7565 7.27724 13.1768 5.33325 9.65047 17.8478 12.146 16.7208 8.36326 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 8.13273 14.1434 8.03644 13.1868 5.69671 9.65047 19.1945 12.7234 16.7208 8.36326 numMergedOcc 0
7 mol 127 unq 0 iso 0 dist 8.09965 11.3174 9.30299 15.4787 8.60326 9.42513 11.2799 9.8685 4.70935 9.16999 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 7.00798 5.57978 8.54584 14.6058 14.5776 9.28278 10.1824 13.5311 5.56946 9.0455 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.94909 8.76089 7.11802 5.7232 5.37072 9.50322 6.45157 5.86531 6.26797 7.12336 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 8.94909 6.80087 8.00618 5.7232 5.37072 5.82404 6.45157 5.86531 9.73435 7.12336 numMergedOcc 0
11 mol 196 unq 0 iso 0 dist 8.69629 4.76275 9.62191 8.36119 6.70722 9.99314 7.06113 6.87731 4.59462 7.556 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 8.84872 4.28841 5.4638 10.014 5.23741 8.48065 7.44501 9.11256 6.84447 8.92054 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 5.99187 5.74685 6.22714 15.0135 12.2428 9.66555 10.2274 10.9193 5.60375 7.82564 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 5.99187 5.74685 6.22714 15.0135 12.2428 9.66555 14.2671 14.9617 10.42 9.51177 numMergedOcc 0
15 mol 238 unq 2 iso 0 dist 5.99187 5.74685 6.22714 13.0521 8.66185 8.67205 10.2274 10.9193 5.60375 9.91136 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 5.31858 6.60345 6.42289 8.62592 7.52881 5.73834 8.95242 10.3938 4.16729 8.37512 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 5.29682 5.56656 8.13497 8.93002 6.64729 8.06771 6.00285 5.90645 10.4985 9.05363 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 6.20344 5.56656 7.88519 8.93002 9.79538 8.06771 6.00285 9.73107 10.4985 9.05363 numMergedOcc 0
19 mol 259 unq 2 iso 0 dist 6.20344 10.3156 7.46176 18.2527 15.3806 9.54857 15.0681 10.5892 5.41945 7.34794 numMergedOcc 0
