0 mol 19 unq 0 iso 0 dist 8.96529 9.83305 14.2304 11.5235 8.18518 17.1733 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 6.10337 9.60643 5.70449 4.60249 8.55122 11.3249 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.29561 8.35897 8.27702 12.429 6.85305 13.8529 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 8.49449 9.46633 7.13948 5.53748 6.25914 6.65254 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 8.49449 9.46633 7.13948 10.307 6.03755 8.97965 numMergedOcc 0
5 mol 55 unq 2 iso 0 dist 6.45963 8.60174 13.7324 4.53728 6.25914 12.6406 numMergedOcc 0
6 mol 55 unq 3 iso 0 dist 6.45963 8.60174 13.7324 5.70356 6.03755 13.7818 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 7.81025 8.814 5.48662 5.4779 6.87176 7.89424 numMergedOcc 0
8 mol 68 unq 1 iso 0 dist 7.81025 8.814 5.48662 6.38698 7.45675 10.2228 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 9.75856 9.05693 16.2126 11.3232 7.76275 20.0443 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 9.75856 7.45361 6.09578 11.3232 7.76275 11.3747 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 9.26301 8.14574 5.50163 15.8173 9.24515 12.0042 numMergedOcc 0
12 mol 132 unq 0 iso 0 dist 8.97036 6.71787 8.41467 13.8837 6.495 12.625 numMergedOcc 0
13 mol 132 unq 1 iso 0 dist 8.97036 6.71787 8.41467 14.8844 9.43748 14.9674 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 8.70916 9.9429 5.20083 5.56707 7.15203 10.229 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 9.6112 6.35449 6.57809 8.99682 5.30872 9.35213 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 6.06276 8.11023 9.68564 8.1066 8.34161 15.5202 numMergedOcc 0
17 mol 158 unq 1 iso 0 dist 6.06276 8.11023 9.68564 5.155 6.95381 11.251 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 8.68482 9.92924 15.6012 4.65392 7.7292 9.44947 numMergedOcc 0
19 mol 204 unq 1 iso 0 dist 8.68482 9.92924 15.6012 11.0965 6.27396 18.8751 numMergedOcc 0
20 mol 284 unq 0 iso 0 dist 6.05336 5.61876 6.1466 8.82631 7.2795 11.2628 numMergedOcc 0
21 mol 284 unq 1 iso 0 dist 6.05336 5.61876 6.1466 13.559 9.41428 14.5084 numMergedOcc 0
