0 mol 7 unq 0 iso 0 dist 5.51421 6.769 6.8464 3.52338 7.78327 10.1033 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 6.51397 9.39983 5.24341 12.8646 8.14998 4.07023 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 6.51397 11.0466 7.67661 12.8646 8.14998 7.19188 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 9.7522 4.21886 9.80897 3.30063 7.98005 4.28862 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.7522 4.21886 9.80897 8.44515 8.31381 4.93643 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 9.7522 8.25891 8.37225 3.30063 7.98005 5.34503 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 9.7522 8.25891 8.37225 8.44515 8.31381 4.74002 numMergedOcc 0
7 mol 34 unq 0 iso 0 dist 7.10899 5.70643 7.78892 12.1168 9.99939 9.30664 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 8.38387 4.99287 8.03754 4.15592 9.02471 3.83842 numMergedOcc 0
9 mol 46 unq 0 iso 0 dist 9.77553 4.5746 9.86627 12.4324 9.45756 10.7471 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 9.00229 12.9552 9.75265 4.82623 8.30217 10.4919 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 6.58793 11.4201 9.67557 12.1387 8.04242 4.21164 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.35636 8.12468 9.64641 3.98588 8.11702 4.41479 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 8.35636 8.12468 9.64641 12.1455 7.44558 10.3271 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 6.78949 4.24711 8.75778 6.80573 4.42563 6.39355 numMergedOcc 0
15 mol 122 unq 1 iso 0 dist 9.40018 13.7131 8.75778 12.9961 4.42563 6.39355 numMergedOcc 0
16 mol 129 unq 0 iso 0 dist 9.28278 4.74644 8.00624 3.54691 7.97548 6.61102 numMergedOcc 0
17 mol 129 unq 1 iso 0 dist 9.28278 4.74644 8.00624 5.56761 9.64164 9.0678 numMergedOcc 0
18 mol 129 unq 2 iso 0 dist 8.78082 4.74644 8.42289 3.54691 7.32151 6.61102 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 8.07256 4.81561 8.41774 12.8334 9.00072 15.2106 numMergedOcc 0
20 mol 163 unq 0 iso 0 dist 9.63873 9.20952 8.32426 14.9742 9.90947 6.32469 numMergedOcc 0
21 mol 163 unq 1 iso 0 dist 9.63873 9.20952 8.32426 13.5948 8.16252 5.57089 numMergedOcc 0
22 mol 167 unq 0 iso 0 dist 5.59806 9.13316 9.23645 5.09728 5.36671 11.1876 numMergedOcc 0
23 mol 197 unq 0 iso 0 dist 8.3337 14.6381 8.67786 3.70636 9.23086 14.0686 numMergedOcc 0
24 mol 206 unq 0 iso 0 dist 9.36079 15.9979 8.11407 12.9317 4.51255 3.98316 numMergedOcc 0
25 mol 206 unq 1 iso 0 dist 7.42904 13.397 8.11407 10.8126 4.51255 3.98316 numMergedOcc 0
26 mol 261 unq 0 iso 0 dist 9.73983 5.96176 7.00833 10.4014 8.24356 4.80385 numMergedOcc 0
27 mol 274 unq 0 iso 0 dist 8.49076 5.02003 8.88221 7.72539 8.12739 4.66969 numMergedOcc 0
28 mol 274 unq 1 iso 0 dist 8.49076 5.02003 8.88221 8.78528 6.09853 5.69247 numMergedOcc 0
29 mol 274 unq 2 iso 0 dist 8.49076 12.6116 9.65027 7.72539 8.12739 12.3693 numMergedOcc 0
30 mol 274 unq 3 iso 0 dist 8.49076 12.6116 9.65027 8.78528 6.09853 6.93195 numMergedOcc 0
31 mol 277 unq 0 iso 0 dist 9.29635 12.5633 4.81916 7.31817 4.9764 9.21484 numMergedOcc 0
32 mol 277 unq 1 iso 0 dist 9.29635 12.5633 4.81916 3.91224 6.36559 10.3506 numMergedOcc 0
33 mol 287 unq 0 iso 0 dist 9.53313 8.80315 9.32175 6.09704 9.76232 3.65914 numMergedOcc 0
34 mol 287 unq 1 iso 0 dist 7.26542 6.53276 9.32175 5.42266 9.76232 3.65914 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 9.53313 8.80315 9.32175 6.09704 9.76232 3.65914 numMergedOcc 0
36 mol 288 unq 1 iso 0 dist 7.26542 6.53276 9.32175 5.42266 9.76232 3.65914 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 9.53313 8.80315 9.32175 6.09704 9.76232 3.65914 numMergedOcc 0
38 mol 289 unq 1 iso 0 dist 7.26542 6.53276 9.32175 5.42266 9.76232 3.65914 numMergedOcc 0
