0 mol 5 unq 0 iso 0 dist 9.41648 8.87863 11.6969 8.80355 17.2803 9.50135 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 5.85008 6.02824 6.41221 5.58536 3.5215 7.69482 numMergedOcc 0
2 mol 36 unq 1 iso 0 dist 9.54644 6.1084 6.41221 6.6055 11.721 10.5994 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 6.47185 9.72136 13.7886 9.942 15.3318 3.7765 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 6.47185 9.72136 13.7886 5.92771 3.8412 13.4768 numMergedOcc 0
5 mol 46 unq 2 iso 0 dist 6.47185 4.61355 8.70524 9.942 15.3318 9.44812 numMergedOcc 0
6 mol 46 unq 3 iso 0 dist 6.47185 4.61355 8.70524 5.92771 3.8412 6.08836 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 6.69386 5.92285 6.44497 6.42645 10.4041 5.98227 numMergedOcc 0
8 mol 62 unq 1 iso 0 dist 6.69386 8.38687 13.6782 6.42645 10.4041 5.87787 numMergedOcc 0
9 mol 62 unq 2 iso 0 dist 9.09269 5.92285 8.03921 6.42645 3.70802 5.98227 numMergedOcc 0
10 mol 62 unq 3 iso 0 dist 9.09269 8.38687 3.83635 6.42645 3.70802 5.87787 numMergedOcc 0
11 mol 69 unq 0 iso 0 dist 8.61203 6.22498 4.13643 7.07055 7.7289 3.78604 numMergedOcc 0
12 mol 83 unq 0 iso 0 dist 9.54935 6.61587 5.03778 6.72584 6.46071 3.31218 numMergedOcc 0
13 mol 83 unq 1 iso 0 dist 9.54935 6.61587 5.03778 7.25594 3.96895 5.74818 numMergedOcc 0
14 mol 83 unq 2 iso 0 dist 9.54935 8.24464 8.54787 6.72584 6.46071 9.11262 numMergedOcc 0
15 mol 83 unq 3 iso 0 dist 9.54935 8.24464 8.54787 7.25594 3.96895 9.84043 numMergedOcc 0
16 mol 103 unq 0 iso 0 dist 9.66944 9.43076 4.3208 7.85115 15.8357 14.3087 numMergedOcc 0
17 mol 112 unq 0 iso 0 dist 7.59407 6.93938 4.03471 7.87345 10.207 12.3755 numMergedOcc 0
18 mol 112 unq 1 iso 0 dist 7.59407 6.93938 4.03471 9.01196 4.52589 5.70307 numMergedOcc 0
19 mol 122 unq 0 iso 0 dist 9.00703 5.42764 4.58216 8.88554 8.17011 6.58474 numMergedOcc 0
20 mol 123 unq 0 iso 0 dist 9.22679 8.6441 9.51508 5.18305 9.35964 8.42496 numMergedOcc 0
21 mol 123 unq 1 iso 0 dist 9.22679 8.6441 9.51508 6.13025 5.76711 11.5607 numMergedOcc 0
22 mol 123 unq 2 iso 0 dist 9.22679 8.6441 9.51508 6.78431 7.69442 3.3389 numMergedOcc 0
23 mol 182 unq 0 iso 0 dist 8.86262 8.45614 4.66231 8.43599 10.0547 12.3855 numMergedOcc 0
24 mol 182 unq 1 iso 0 dist 7.23874 8.45614 9.47983 8.43599 3.51217 12.3855 numMergedOcc 0
25 mol 218 unq 0 iso 0 dist 6.43416 5.92364 3.85734 8.5458 9.83826 6.16586 numMergedOcc 0
26 mol 284 unq 0 iso 0 dist 7.41633 6.52085 11.6034 4.69611 5.88619 6.53775 numMergedOcc 0
27 mol 284 unq 1 iso 0 dist 7.41633 9.84174 14.3977 4.69611 5.88619 13.4014 numMergedOcc 0
28 mol 284 unq 2 iso 0 dist 5.52837 6.52085 8.17165 4.69611 4.57529 6.53775 numMergedOcc 0
29 mol 284 unq 3 iso 0 dist 5.52837 9.84174 11.148 4.69611 4.57529 13.4014 numMergedOcc 0
30 mol 284 unq 4 iso 0 dist 6.73163 6.52085 4.03077 4.69611 5.2614 6.53775 numMergedOcc 0
31 mol 284 unq 5 iso 0 dist 6.73163 9.84174 11.131 4.69611 5.2614 13.4014 numMergedOcc 0
32 mol 287 unq 0 iso 0 dist 6.81636 7.74312 8.93497 8.08382 11.4589 3.66473 numMergedOcc 0
33 mol 288 unq 0 iso 0 dist 6.81636 7.74312 8.93497 8.08382 11.4589 3.66473 numMergedOcc 0
34 mol 289 unq 0 iso 0 dist 6.81636 7.74312 8.93497 8.08382 11.4589 3.66473 numMergedOcc 0
