0 mol 55 unq 0 iso 0 dist 5.7638 6.58179 5.44338 7.01781 10.2889 8.0388 numMergedOcc 0
1 mol 55 unq 1 iso 0 dist 8.55679 6.58179 10.6068 7.01781 12.9947 8.0388 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.92027 9.1926 12.8256 16.8488 21.1776 9.52356 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 8.54119 8.06894 6.42684 10.2511 7.89201 9.07614 numMergedOcc 0
4 mol 63 unq 1 iso 0 dist 8.54119 8.06894 6.42684 8.58152 13.6051 9.21258 numMergedOcc 0
5 mol 81 unq 0 iso 0 dist 8.68497 4.95504 12.9904 8.80404 14.8161 9.61211 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.66549 9.27814 7.41484 15.4847 15.5878 9.22903 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 8.36172 7.59747 6.88119 6.69022 13.8394 9.45247 numMergedOcc 0
8 mol 124 unq 0 iso 0 dist 8.48985 9.01881 13.2981 5.20574 12.6131 8.636 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 5.70772 8.94352 10.5092 4.93601 5.82034 8.62135 numMergedOcc 0
10 mol 196 unq 0 iso 0 dist 8.78916 8.32524 3.56238 3.93203 10.7748 8.9563 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 9.58385 8.52735 3.49673 8.16509 11.3652 8.13294 numMergedOcc 0
12 mol 225 unq 1 iso 0 dist 6.83539 8.52735 3.42123 8.16509 7.0795 8.13294 numMergedOcc 0
13 mol 225 unq 2 iso 0 dist 6.22747 8.52735 5.59654 8.16509 9.76251 8.13294 numMergedOcc 0
14 mol 225 unq 3 iso 0 dist 9.21404 8.52735 14.7084 8.16509 17.2634 8.13294 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 6.81644 7.39884 3.79865 7.62457 10.7621 9.7465 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 9.96682 6.32853 8.78528 5.69575 12.9839 8.23254 numMergedOcc 0
17 mol 283 unq 0 iso 0 dist 8.28068 7.17276 6.35533 5.08363 8.80418 8.91437 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.19213 8.15636 8.78444 12.4032 16.2021 7.81225 numMergedOcc 0
19 mol 287 unq 1 iso 0 dist 5.80664 8.15636 12.0542 12.4032 16.5172 7.81225 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 8.19213 8.15636 8.78444 12.4032 16.2021 7.81225 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 5.80664 8.15636 12.0542 12.4032 16.5172 7.81225 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 8.19213 8.15636 8.78444 12.4032 16.2021 7.81225 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 5.80664 8.15636 12.0542 12.4032 16.5172 7.81225 numMergedOcc 0
