0 mol 20 unq 0 iso 0 dist 9.0017 9.47299 8.72342 6.22202 8.26091 3.59314 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.18124 3.4435 7.85986 7.19357 8.25818 9.63925 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.10168 15.6705 7.85986 13.7061 8.25818 9.63925 numMergedOcc 0
3 mol 28 unq 0 iso 0 dist 8.90935 3.69138 8.69709 11.9912 7.08766 10.8722 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 7.90364 5.68596 6.28603 5.54746 5.54472 3.50984 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 7.78518 5.69576 5.73454 5.76412 5.37439 3.65036 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 6.9447 5.39918 5.56839 3.80877 5.20429 5.01255 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 6.9447 5.39918 5.56839 12.771 8.71366 9.11323 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 6.9447 9.73503 7.83506 3.80877 5.20429 8.98901 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 6.9447 9.73503 7.83506 12.771 8.71366 8.52329 numMergedOcc 0
10 mol 111 unq 0 iso 0 dist 6.34004 3.67964 9.72371 5.39108 4.91212 8.83426 numMergedOcc 0
11 mol 111 unq 1 iso 0 dist 6.34004 3.67964 9.72371 13.201 9.34782 16.815 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 8.46167 8.69658 7.40338 4.62493 5.31126 6.29259 numMergedOcc 0
13 mol 113 unq 1 iso 0 dist 8.46167 8.69658 7.40338 6.47997 7.16619 7.08122 numMergedOcc 0
14 mol 113 unq 2 iso 0 dist 8.46167 11.1416 6.23759 4.62493 5.31126 8.17309 numMergedOcc 0
15 mol 113 unq 3 iso 0 dist 8.46167 11.1416 6.23759 6.47997 7.16619 9.30967 numMergedOcc 0
16 mol 123 unq 0 iso 0 dist 8.20345 5.25923 9.42762 3.21474 8.78115 4.10526 numMergedOcc 0
17 mol 123 unq 1 iso 0 dist 8.24171 9.04448 7.30244 3.00129 5.56127 7.88813 numMergedOcc 0
18 mol 123 unq 2 iso 0 dist 8.24171 9.04448 7.30244 12.1183 8.03692 4.10526 numMergedOcc 0
19 mol 123 unq 3 iso 0 dist 8.24171 9.04448 7.30244 10.7803 5.36214 12.6384 numMergedOcc 0
20 mol 123 unq 4 iso 0 dist 5.38148 5.25923 7.30244 8.56894 5.56127 7.88813 numMergedOcc 0
21 mol 123 unq 5 iso 0 dist 5.38148 5.25923 7.30244 3.21474 8.03692 4.10526 numMergedOcc 0
22 mol 123 unq 6 iso 0 dist 5.38148 5.25923 7.30244 9.94939 5.36214 12.6384 numMergedOcc 0
23 mol 123 unq 7 iso 0 dist 6.63094 11.8191 7.30244 5.2546 5.56127 7.88813 numMergedOcc 0
24 mol 123 unq 8 iso 0 dist 6.63094 11.8191 7.30244 12.6794 8.03692 4.10526 numMergedOcc 0
25 mol 123 unq 9 iso 0 dist 6.63094 11.8191 7.30244 5.79985 5.36214 12.6384 numMergedOcc 0
26 mol 131 unq 0 iso 0 dist 9.8911 5.06665 7.84546 4.86495 7.53342 4.94367 numMergedOcc 0
27 mol 131 unq 1 iso 0 dist 7.02043 7.7998 7.84546 3.38209 7.53342 4.94367 numMergedOcc 0
28 mol 141 unq 0 iso 0 dist 8.56285 8.90481 9.59109 11.8161 4.88514 13.8739 numMergedOcc 0
29 mol 169 unq 0 iso 0 dist 9.39809 8.16591 7.85698 6.05322 5.10589 6.28646 numMergedOcc 0
30 mol 169 unq 1 iso 0 dist 9.39809 10.2799 6.35799 6.05322 5.10589 7.83748 numMergedOcc 0
31 mol 186 unq 0 iso 0 dist 9.64977 15.9388 9.31569 13.3603 7.25595 9.73374 numMergedOcc 0
32 mol 186 unq 1 iso 0 dist 9.64977 15.9388 9.31569 11.4647 9.94825 7.47658 numMergedOcc 0
33 mol 186 unq 2 iso 0 dist 9.64977 4.04186 8.72743 13.3603 7.25595 14.2269 numMergedOcc 0
34 mol 186 unq 3 iso 0 dist 9.64977 4.04186 8.72743 11.4647 9.94825 9.76301 numMergedOcc 0
35 mol 206 unq 0 iso 0 dist 9.24832 7.87274 7.9416 9.90756 6.80296 9.36584 numMergedOcc 0
36 mol 214 unq 0 iso 0 dist 9.07582 9.11338 5.05626 13.7118 8.66082 6.28944 numMergedOcc 0
37 mol 214 unq 1 iso 0 dist 8.62183 10.6097 5.05626 14.3245 8.66082 6.28944 numMergedOcc 0
38 mol 254 unq 0 iso 0 dist 6.34051 12.3017 9.50951 5.14008 9.20109 11.9238 numMergedOcc 0
39 mol 284 unq 0 iso 0 dist 8.82497 12.1931 7.74874 8.65336 5.6964 3.57807 numMergedOcc 0
40 mol 287 unq 0 iso 0 dist 9.97939 12.4081 8.58427 7.67746 4.68668 9.88575 numMergedOcc 0
41 mol 288 unq 0 iso 0 dist 9.97939 12.4081 8.58427 7.67746 4.68668 9.88575 numMergedOcc 0
42 mol 289 unq 0 iso 0 dist 9.97939 12.4081 8.58427 7.67746 4.68668 9.88575 numMergedOcc 0
