0 mol 16 unq 0 iso 0 dist 8.46837 11.958 8.33883 5.66529 5.77753 6.2983 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.17472 5.3372 6.87871 8.02212 8.82122 6.29127 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 7.84699 13.4367 6.89722 10.0721 6.4154 7.41074 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.40844 5.33851 9.68526 14.8445 9.67601 12.3103 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.40844 13.4367 7.26679 14.8445 9.67601 15.1106 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.40844 15.7164 9.30776 14.8445 9.67601 6.04779 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 7.02351 13.6586 9.68526 5.41354 9.67601 12.3103 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 7.02351 10.3774 7.26679 5.41354 9.67601 15.1106 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 7.02351 4.15333 9.30776 5.41354 9.67601 6.04779 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 7.53504 9.64124 6.89722 13.2987 6.4154 7.41074 numMergedOcc 0
10 mol 73 unq 8 iso 0 dist 8.66342 16.8585 9.68526 15.5344 9.67601 12.3103 numMergedOcc 0
11 mol 73 unq 9 iso 0 dist 8.66342 9.64124 7.26679 15.5344 9.67601 15.1106 numMergedOcc 0
12 mol 73 unq 10 iso 0 dist 8.66342 16.0481 9.30776 15.5344 9.67601 6.04779 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 7.26246 4.82943 7.38759 8.13159 7.42204 9.32452 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 8.6728 10.602 7.38759 5.54452 7.42204 9.32452 numMergedOcc 0
15 mol 102 unq 0 iso 0 dist 7.59973 10.3418 9.43411 12.7125 9.50209 4.32286 numMergedOcc 0
16 mol 102 unq 1 iso 0 dist 7.59973 13.9809 9.80678 12.7125 9.50209 5.498 numMergedOcc 0
17 mol 111 unq 0 iso 0 dist 8.41868 10.9559 8.42147 4.57308 4.9128 7.59143 numMergedOcc 0
18 mol 122 unq 0 iso 0 dist 9.44209 11.9943 8.33083 7.82677 8.40483 5.41882 numMergedOcc 0
19 mol 211 unq 0 iso 0 dist 9.45365 8.91121 8.63308 13.1369 9.97733 4.82752 numMergedOcc 0
20 mol 211 unq 1 iso 0 dist 7.15386 7.03173 8.63308 9.91543 9.97733 4.82752 numMergedOcc 0
21 mol 211 unq 2 iso 0 dist 7.73993 11.6621 8.63308 13.4388 9.97733 4.82752 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 5.69733 5.68711 8.49704 5.24956 6.35728 6.67959 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 7.10689 5.01062 8.7347 4.78647 5.04916 7.61682 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 4.99301 5.25583 6.56437 5.69457 8.7868 5.70973 numMergedOcc 0
25 mol 224 unq 1 iso 0 dist 6.36813 5.25583 6.23882 5.69457 4.64336 5.70973 numMergedOcc 0
26 mol 224 unq 2 iso 0 dist 7.7163 11.8217 9.34636 4.92261 8.60781 7.98696 numMergedOcc 0
27 mol 224 unq 3 iso 0 dist 7.7163 10.8463 9.79616 4.92261 8.60781 7.12232 numMergedOcc 0
28 mol 224 unq 4 iso 0 dist 9.06201 11.9904 9.34636 6.78064 8.60781 7.98696 numMergedOcc 0
29 mol 224 unq 5 iso 0 dist 9.06201 13.0574 9.79616 6.78064 8.60781 7.12232 numMergedOcc 0
30 mol 226 unq 0 iso 0 dist 9.05082 10.78 9.5723 12.1713 6.44662 9.45057 numMergedOcc 0
31 mol 227 unq 0 iso 0 dist 7.99145 5.841 9.17826 10.2228 8.34104 6.43754 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 5.96276 5.55516 5.90381 6.34634 5.70124 5.20486 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 5.68643 7.48637 9.91395 9.3038 9.36111 10.9108 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 8.36043 8.13367 9.81815 9.3038 6.75233 4.51676 numMergedOcc 0
35 mol 274 unq 2 iso 0 dist 7.24089 5.56999 6.00877 5.06637 5.42845 5.31116 numMergedOcc 0
36 mol 274 unq 3 iso 0 dist 9.96645 6.04536 9.696 6.13137 5.12523 6.8406 numMergedOcc 0
37 mol 274 unq 4 iso 0 dist 9.29005 10.2696 6.00877 5.18671 5.42845 5.31116 numMergedOcc 0
38 mol 274 unq 5 iso 0 dist 8.16746 10.2696 8.66451 5.18671 5.62484 5.31116 numMergedOcc 0
39 mol 274 unq 6 iso 0 dist 9.2447 6.12463 9.696 5.06306 5.12523 6.8406 numMergedOcc 0
40 mol 277 unq 0 iso 0 dist 9.42812 10.7202 8.57532 7.4578 6.73204 5.01729 numMergedOcc 0
41 mol 277 unq 1 iso 0 dist 9.42812 17.0927 9.02914 7.4578 6.73204 10.7534 numMergedOcc 0
42 mol 277 unq 2 iso 0 dist 9.42812 16.2915 6.90434 7.4578 6.73204 12.6113 numMergedOcc 0
43 mol 284 unq 0 iso 0 dist 7.80784 6.535 8.42412 9.26331 9.1161 5.21666 numMergedOcc 0
