0 mol 4 unq 0 iso 0 dist 9.30799 11.314 5.39008 11.7791 4.46089 8.23852 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 9.46633 13.6455 8.03504 13.6694 4.60627 9.3239 numMergedOcc 0
2 mol 55 unq 1 iso 0 dist 9.46633 11.2058 7.87739 13.6694 4.60627 8.34632 numMergedOcc 0
3 mol 55 unq 2 iso 0 dist 9.46633 11.2058 7.87739 10.9657 5.55161 5.62629 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 8.78393 4.27997 8.0757 9.71282 4.98324 9.49909 numMergedOcc 0
5 mol 56 unq 1 iso 0 dist 8.78393 11.9782 9.8958 9.71282 4.98324 8.37022 numMergedOcc 0
6 mol 56 unq 2 iso 0 dist 8.99619 6.41952 8.0757 9.95507 4.98324 9.49909 numMergedOcc 0
7 mol 56 unq 3 iso 0 dist 8.99619 4.83605 9.8958 9.95507 4.98324 8.37022 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.40481 11.3093 6.62952 13.3483 11.2334 8.87856 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 7.40481 11.3093 6.62952 8.01128 7.89992 6.2491 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 7.40481 6.41542 4.3521 8.01128 7.89992 3.59451 numMergedOcc 0
11 mol 99 unq 0 iso 0 dist 9.49001 9.15595 9.39801 16.8003 12.5118 8.23566 numMergedOcc 0
12 mol 99 unq 1 iso 0 dist 7.55765 5.91888 4.82346 11.184 4.74328 8.23566 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 8.70947 5.23253 7.11476 11.8503 4.39441 9.1109 numMergedOcc 0
14 mol 101 unq 1 iso 0 dist 8.70947 5.23253 7.11476 5.58941 4.84084 5.51185 numMergedOcc 0
15 mol 104 unq 0 iso 0 dist 5.74478 6.02556 7.32917 13.3711 12.6757 8.53028 numMergedOcc 0
16 mol 105 unq 0 iso 0 dist 5.30577 10.6016 9.96269 13.3255 8.60755 9.87685 numMergedOcc 0
17 mol 120 unq 0 iso 0 dist 9.0655 4.42019 8.8894 9.73488 10.2375 9.40544 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 8.32304 6.8279 6.45169 11.0356 10.1774 7.8034 numMergedOcc 0
19 mol 170 unq 0 iso 0 dist 5.13315 5.2781 9.15159 7.70662 7.9212 5.94075 numMergedOcc 0
20 mol 192 unq 0 iso 0 dist 5.91901 5.88368 5.83093 10.0079 5.21255 7.72242 numMergedOcc 0
21 mol 209 unq 0 iso 0 dist 8.31544 5.96238 8.8886 11.7459 8.13817 7.757 numMergedOcc 0
22 mol 209 unq 1 iso 0 dist 8.31544 5.04469 8.78565 11.7459 8.13817 9.56015 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 8.87704 4.828 7.80073 7.19903 8.20191 8.78008 numMergedOcc 0
24 mol 239 unq 1 iso 0 dist 7.90944 14.6255 7.10828 11.6711 5.94643 8.01565 numMergedOcc 0
25 mol 239 unq 2 iso 0 dist 9.11375 16.0386 7.80073 13.4967 8.20191 8.78008 numMergedOcc 0
26 mol 249 unq 0 iso 0 dist 6.88579 6.08224 5.70674 10.4751 4.88298 6.04688 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 9.64956 11.4415 9.65711 13.2883 9.46467 6.59521 numMergedOcc 0
28 mol 260 unq 0 iso 0 dist 8.67835 6.0591 8.13605 7.246 11.3568 9.05149 numMergedOcc 0
29 mol 267 unq 0 iso 0 dist 7.71379 5.05875 6.79491 8.07801 9.17078 5.32643 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 5.37738 10.6569 6.40125 10.6323 6.08499 8.83777 numMergedOcc 0
31 mol 277 unq 1 iso 0 dist 5.37738 10.6569 6.40125 12.1099 10.3278 9.42812 numMergedOcc 0
32 mol 279 unq 0 iso 0 dist 6.74021 5.33357 8.52827 11.9045 10.2078 8.87355 numMergedOcc 0
33 mol 279 unq 1 iso 0 dist 6.74021 9.67694 7.14122 11.9045 10.2078 8.18179 numMergedOcc 0
34 mol 279 unq 2 iso 0 dist 6.74021 9.67694 7.14122 11.323 4.8005 7.45556 numMergedOcc 0
35 mol 279 unq 3 iso 0 dist 6.74021 9.67694 7.14122 13.4086 8.61009 5.25218 numMergedOcc 0
