0 mol 7 unq 0 iso 0 dist 7.15434 7.29541 5.72491 8.75346 9.67164 8.0744 16.3188 10.789 9.55056 14.144 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.15434 7.29541 5.72491 8.75346 9.67164 8.0744 13.7477 10.515 7.45262 8.81608 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 9.16444 6.84888 7.05346 6.92407 8.30653 4.3947 12.374 13.5628 9.82483 13.9961 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 9.77018 7.79856 8.63486 12.6833 9.2898 15.8558 10.6971 11.2318 8.98797 13.5478 numMergedOcc 0
4 mol 56 unq 1 iso 0 dist 8.96238 6.5705 6.77886 12.9131 9.03564 10.5332 9.50913 10.9467 5.86571 16.2662 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.62648 8.9683 8.56342 12.6962 7.64052 6.29394 16.6083 10.0197 9.87025 6.13374 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 8.62648 8.9683 8.56342 12.6962 7.64052 6.29394 12.5653 10.6679 5.85818 9.08536 numMergedOcc 0
7 mol 159 unq 0 iso 0 dist 7.47975 9.78249 7.25742 7.21999 9.36259 5.34453 10.4366 4.57561 7.13269 10.7736 numMergedOcc 0
8 mol 195 unq 0 iso 0 dist 8.3705 9.80071 7.62942 4.29894 9.03441 8.89297 9.75763 6.08211 9.79691 12.3988 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 4.851 11.3699 9.20961 6.13691 6.67404 6.57708 13.6078 11.4148 6.86795 11.2108 numMergedOcc 0
10 mol 218 unq 1 iso 0 dist 4.851 11.3699 9.20961 6.13691 6.67404 6.57708 16.4932 12.7963 6.61099 12.5343 numMergedOcc 0
11 mol 227 unq 0 iso 0 dist 9.60159 11.2986 8.38865 5.19262 5.23634 7.3164 17.394 9.60993 9.20589 12.2075 numMergedOcc 0
12 mol 227 unq 1 iso 0 dist 9.60159 11.2986 8.38865 5.19262 5.23634 7.3164 15.267 13.3557 7.89801 11.5426 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 8.96639 6.85179 6.4398 9.54858 8.82351 6.22195 11.8385 15.3074 9.42618 13.8196 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 9.38753 8.09178 5.52379 11.5133 9.07475 6.50998 14.4733 11.6239 7.61203 11.316 numMergedOcc 0
15 mol 238 unq 2 iso 0 dist 9.38753 8.09178 5.52379 11.5133 9.07475 6.50998 13.4578 13.9614 9.47845 14.1582 numMergedOcc 0
16 mol 238 unq 3 iso 0 dist 9.38753 8.09178 5.52379 11.5133 9.07475 6.50998 10.6591 12.3042 6.92409 10.2916 numMergedOcc 0
17 mol 238 unq 4 iso 0 dist 9.38753 8.09178 5.52379 11.5133 9.07475 6.50998 13.9257 5.54325 6.89694 8.82776 numMergedOcc 0
18 mol 238 unq 5 iso 0 dist 9.38753 8.09178 5.52379 12.2802 6.99888 5.63944 14.4733 11.6239 7.61203 9.99105 numMergedOcc 0
19 mol 238 unq 6 iso 0 dist 9.38753 8.09178 5.52379 12.2802 6.99888 5.63944 13.4578 13.9614 9.47845 13.7042 numMergedOcc 0
20 mol 238 unq 7 iso 0 dist 9.38753 8.09178 5.52379 12.2802 6.99888 5.63944 10.6591 12.3042 6.92409 10.8123 numMergedOcc 0
21 mol 238 unq 8 iso 0 dist 9.38753 8.09178 5.52379 12.2802 6.99888 5.63944 13.9257 5.54325 6.89694 5.43613 numMergedOcc 0
22 mol 264 unq 0 iso 0 dist 6.8902 5.86656 6.14323 9.58347 8.29262 5.82131 13.4211 12.3807 9.42738 13.8261 numMergedOcc 0
