0 mol 6 unq 0 iso 0 dist 9.12796 6.36157 8.60722 8.15992 12.0011 5.27713 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 6.1462 6.36157 8.54844 8.15992 11.5054 5.27713 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.00925 8.68949 16.2669 9.31461 15.5014 3.84732 numMergedOcc 0
3 mol 10 unq 0 iso 0 dist 8.99402 9.78153 17.1926 8.16906 5.05883 14.8787 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 9.3147 8.75001 10.2713 9.97466 15.257 12.5764 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 9.79426 8.75001 12.053 9.97466 4.78277 12.5764 numMergedOcc 0
6 mol 21 unq 0 iso 0 dist 9.50179 8.6232 5.89271 5.92388 4.56848 3.36756 numMergedOcc 0
7 mol 21 unq 1 iso 0 dist 6.72231 8.6232 5.10048 5.92388 4.71732 3.36756 numMergedOcc 0
8 mol 30 unq 0 iso 0 dist 7.83595 8.204 10.5615 7.88072 7.22162 3.90342 numMergedOcc 0
9 mol 42 unq 0 iso 0 dist 8.84148 5.52834 5.21506 7.53194 4.80255 4.62559 numMergedOcc 0
10 mol 48 unq 0 iso 0 dist 7.38928 9.40644 8.74683 7.99434 9.85208 3.85292 numMergedOcc 0
11 mol 48 unq 1 iso 0 dist 7.38928 5.35252 5.03338 7.99434 9.85208 6.44604 numMergedOcc 0
12 mol 48 unq 2 iso 0 dist 8.36915 9.53081 13.2937 5.43913 5.44336 13.4515 numMergedOcc 0
13 mol 48 unq 3 iso 0 dist 8.36915 9.53081 13.2937 8.26877 10.4965 17.6258 numMergedOcc 0
14 mol 48 unq 4 iso 0 dist 6.01454 9.53081 5.41488 5.43913 9.12054 13.4515 numMergedOcc 0
15 mol 48 unq 5 iso 0 dist 6.01454 9.53081 5.41488 8.26877 13.688 17.6258 numMergedOcc 0
16 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 6.65972 8.14479 4.13187 numMergedOcc 0
17 mol 79 unq 1 iso 0 dist 7.41952 8.64686 9.57704 4.2253 9.07516 9.13196 numMergedOcc 0
18 mol 90 unq 0 iso 0 dist 6.6146 9.06641 5.12529 8.63446 3.78122 6.65219 numMergedOcc 0
19 mol 91 unq 0 iso 0 dist 5.78962 8.91354 7.47242 8.91998 5.4863 10.8497 numMergedOcc 0
20 mol 127 unq 0 iso 0 dist 8.98151 5.83719 8.21735 9.64136 4.24788 11.1718 numMergedOcc 0
21 mol 129 unq 0 iso 0 dist 7.07421 7.6453 5.06265 4.4077 6.14663 6.61102 numMergedOcc 0
22 mol 129 unq 1 iso 0 dist 7.07421 7.6453 5.06265 8.4874 5.32811 9.0678 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 9.07294 5.79195 5.35551 9.35049 3.75786 4.63862 numMergedOcc 0
24 mol 143 unq 0 iso 0 dist 6.68364 6.87456 7.87375 8.10681 9.19685 3.9771 numMergedOcc 0
25 mol 157 unq 0 iso 0 dist 9.668 6.8976 11.1313 8.36016 7.72329 5.07066 numMergedOcc 0
26 mol 165 unq 0 iso 0 dist 9.59989 6.85551 9.94274 9.98689 9.80262 6.21834 numMergedOcc 0
27 mol 165 unq 1 iso 0 dist 9.59989 6.85551 9.94274 5.93144 11.7431 11.5982 numMergedOcc 0
28 mol 167 unq 0 iso 0 dist 9.82329 7.20545 9.97915 8.43955 9.16459 6.87479 numMergedOcc 0
29 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 9.12589 9.6014 9.57585 numMergedOcc 0
30 mol 186 unq 1 iso 0 dist 7.02662 8.72949 8.01622 9.12589 9.6014 3.91982 numMergedOcc 0
31 mol 198 unq 0 iso 0 dist 4.58291 8.51153 3.96154 7.94413 6.52619 7.14873 numMergedOcc 0
32 mol 204 unq 0 iso 0 dist 7.00683 9.52029 8.61406 9.41594 4.96901 9.47121 numMergedOcc 0
33 mol 204 unq 1 iso 0 dist 7.00683 9.52029 8.61406 9.92651 3.72258 11.8097 numMergedOcc 0
34 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 7.95917 5.30972 4.68656 numMergedOcc 0
35 mol 230 unq 0 iso 0 dist 6.88683 9.24729 11.0843 8.01593 7.62813 3.86973 numMergedOcc 0
36 mol 239 unq 0 iso 0 dist 6.00654 9.01071 12.178 7.24545 6.94281 7.17772 numMergedOcc 0
37 mol 239 unq 1 iso 0 dist 6.00654 8.86185 8.20191 7.24545 6.94281 13.8399 numMergedOcc 0
38 mol 244 unq 0 iso 0 dist 6.51428 7.43391 4.69664 9.3491 12.2668 9.14405 numMergedOcc 0
39 mol 244 unq 1 iso 0 dist 6.51428 7.79787 13.4155 9.3491 12.2668 6.88123 numMergedOcc 0
40 mol 249 unq 0 iso 0 dist 7.58833 3.67935 4.88298 6.62413 7.19269 4.49386 numMergedOcc 0
41 mol 249 unq 1 iso 0 dist 7.58833 8.00386 10.9665 6.62413 7.19269 5.33399 numMergedOcc 0
42 mol 249 unq 2 iso 0 dist 9.04715 3.67935 5.75331 6.62413 4.77145 4.49386 numMergedOcc 0
43 mol 249 unq 3 iso 0 dist 9.04715 8.00386 5.52082 6.62413 4.77145 5.33399 numMergedOcc 0
44 mol 258 unq 0 iso 0 dist 8.97411 8.58092 13.2474 5.94328 8.9947 5.05766 numMergedOcc 0
45 mol 266 unq 0 iso 0 dist 9.77392 9.0836 16.492 6.48382 16.2409 7.63149 numMergedOcc 0
46 mol 266 unq 1 iso 0 dist 9.77392 9.62494 18.9489 6.48382 16.2409 4.39553 numMergedOcc 0
47 mol 274 unq 0 iso 0 dist 6.12202 9.34051 10.3702 8.67957 12.2201 4.66969 numMergedOcc 0
48 mol 279 unq 0 iso 0 dist 5.78017 8.03486 7.78018 9.98182 6.3791 5.04826 numMergedOcc 0
49 mol 279 unq 1 iso 0 dist 8.78203 8.03486 5.38411 9.98182 9.86569 5.04826 numMergedOcc 0
50 mol 287 unq 0 iso 0 dist 8.0935 6.96774 10.4601 9.31611 14.6969 5.03775 numMergedOcc 0
51 mol 287 unq 1 iso 0 dist 8.0935 7.14859 8.13485 9.31611 14.6969 8.95194 numMergedOcc 0
52 mol 288 unq 0 iso 0 dist 8.0935 6.96774 10.4601 9.31611 14.6969 5.03775 numMergedOcc 0
53 mol 288 unq 1 iso 0 dist 8.0935 7.14859 8.13485 9.31611 14.6969 8.95194 numMergedOcc 0
54 mol 289 unq 0 iso 0 dist 8.0935 6.96774 10.4601 9.31611 14.6969 5.03775 numMergedOcc 0
55 mol 289 unq 1 iso 0 dist 8.0935 7.14859 8.13485 9.31611 14.6969 8.95194 numMergedOcc 0
