0 mol 9 unq 0 iso 0 dist 9.16444 6.92407 8.30653 10.1248 5.41626 5.18338 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 6.39243 4.95319 5.65084 6.72533 4.96555 8.43157 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 9.1715 6.19959 5.65084 8.29216 4.96555 8.43157 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 9.28932 6.01658 6.07517 10.5288 5.17518 5.36413 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 9.28932 6.01658 6.07517 11.3169 7.11245 9.30604 numMergedOcc 0
5 mol 30 unq 2 iso 0 dist 7.53042 8.34136 6.07517 10.3961 5.17518 5.36413 numMergedOcc 0
6 mol 30 unq 3 iso 0 dist 7.53042 8.34136 6.07517 14.5036 7.11245 9.30604 numMergedOcc 0
7 mol 30 unq 4 iso 0 dist 6.83481 6.01658 6.74179 10.5288 7.18789 5.36413 numMergedOcc 0
8 mol 30 unq 5 iso 0 dist 6.83481 6.01658 6.74179 11.3169 5.05661 9.30604 numMergedOcc 0
9 mol 39 unq 0 iso 0 dist 9.45639 5.34459 8.70192 12.495 7.14422 8.66992 numMergedOcc 0
10 mol 39 unq 1 iso 0 dist 9.45639 5.34459 8.70192 14.1096 9.80217 9.35025 numMergedOcc 0
11 mol 39 unq 2 iso 0 dist 5.00126 7.71511 8.70192 10.6989 7.14422 8.66992 numMergedOcc 0
12 mol 39 unq 3 iso 0 dist 5.00126 7.71511 8.70192 13.1479 9.80217 9.35025 numMergedOcc 0
13 mol 43 unq 0 iso 0 dist 9.17086 4.9903 6.6263 13.3446 6.6796 9.23033 numMergedOcc 0
14 mol 45 unq 0 iso 0 dist 9.17045 6.3858 5.94756 13.6578 5.2876 8.81519 numMergedOcc 0
15 mol 45 unq 1 iso 0 dist 6.32012 5.52643 5.94756 5.90391 5.2876 8.81519 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 8.16299 6.52486 5.5087 13.3678 6.71593 7.91605 numMergedOcc 0
17 mol 73 unq 1 iso 0 dist 8.16299 10.9731 6.08682 13.3678 6.71593 6.43707 numMergedOcc 0
18 mol 73 unq 2 iso 0 dist 8.27015 13.0059 5.5087 11.9493 6.71593 7.91605 numMergedOcc 0
19 mol 73 unq 3 iso 0 dist 8.27015 14.1533 6.08682 11.9493 6.71593 6.43707 numMergedOcc 0
20 mol 139 unq 0 iso 0 dist 8.32294 7.14578 5.80789 15.5229 10.3273 9.07404 numMergedOcc 0
21 mol 162 unq 0 iso 0 dist 8.46796 8.53742 7.37333 15.9574 8.35998 9.95076 numMergedOcc 0
22 mol 162 unq 1 iso 0 dist 8.46796 11.0013 7.45998 15.9574 8.35998 7.76112 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 4.851 6.13691 6.67404 5.98076 8.31343 8.38813 numMergedOcc 0
24 mol 232 unq 0 iso 0 dist 9.95045 13.3209 6.71524 14.5058 4.90814 9.11418 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 9.38753 11.5133 9.07475 13.7782 5.0871 9.53006 numMergedOcc 0
26 mol 238 unq 1 iso 0 dist 9.38753 12.2802 6.99888 13.7782 5.0871 6.83837 numMergedOcc 0
27 mol 239 unq 0 iso 0 dist 6.83046 8.15025 6.73665 4.21935 5.29737 7.69491 numMergedOcc 0
28 mol 239 unq 1 iso 0 dist 6.83046 8.15025 6.73665 12.5656 11.4465 6.64008 numMergedOcc 0
29 mol 279 unq 0 iso 0 dist 8.68797 5.03816 6.35028 8.36655 5.34376 8.9352 numMergedOcc 0
30 mol 279 unq 1 iso 0 dist 8.68797 5.03816 6.35028 10.6842 5.86731 5.8845 numMergedOcc 0
