0 mol 2 unq 0 iso 0 dist 9.97181 11.9475 5.92719 8.64872 6.61168 3.89238 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.33568 15.8175 9.4228 13.7733 6.29237 4.95725 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 9.33568 15.8175 9.4228 17.2226 9.24286 5.84217 numMergedOcc 0
3 mol 20 unq 2 iso 0 dist 9.78224 10.7399 9.39046 11.0737 8.19319 5.12224 numMergedOcc 0
4 mol 20 unq 3 iso 0 dist 7.57379 8.60765 9.39046 4.99944 8.19319 5.12224 numMergedOcc 0
5 mol 21 unq 0 iso 0 dist 9.42165 5.60021 7.39438 10.1809 7.01701 5.06402 numMergedOcc 0
6 mol 29 unq 0 iso 0 dist 5.92844 6.2924 8.94936 4.98274 6.34665 6.37468 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 9.23087 8.66168 9.18809 9.2457 6.33905 7.50975 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.00779 6.71593 5.62694 4.19129 8.31317 6.41115 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 9.5771 8.88286 8.69749 6.67286 9.44847 3.94537 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 8.60452 8.88286 5.96576 6.67286 6.05839 3.94537 numMergedOcc 0
11 mol 108 unq 0 iso 0 dist 9.01604 12.7166 9.13454 9.02772 9.78419 5.7894 numMergedOcc 0
12 mol 116 unq 0 iso 0 dist 8.07119 3.97609 8.10448 5.81344 9.02925 3.87365 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 7.33646 13.5588 8.82676 4.65331 6.81354 9.95656 numMergedOcc 0
14 mol 127 unq 1 iso 0 dist 7.33646 11.1351 8.17522 4.65331 6.81354 8.95351 numMergedOcc 0
15 mol 127 unq 2 iso 0 dist 7.33646 6.08871 8.14341 4.65331 6.81354 6.15686 numMergedOcc 0
16 mol 127 unq 3 iso 0 dist 7.33646 5.35462 6.54744 4.65331 6.81354 4.89159 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 8.78286 5.93275 5.62219 16.6847 8.96211 11.3763 numMergedOcc 0
18 mol 219 unq 0 iso 0 dist 6.65093 10.0509 7.68645 5.05436 6.44817 11.3569 numMergedOcc 0
19 mol 219 unq 1 iso 0 dist 6.65093 10.0509 7.68645 15.414 9.36547 9.13819 numMergedOcc 0
20 mol 219 unq 2 iso 0 dist 6.65093 5.48556 5.75017 5.05436 6.44817 4.78402 numMergedOcc 0
21 mol 219 unq 3 iso 0 dist 6.65093 5.48556 5.75017 15.414 9.36547 11.6561 numMergedOcc 0
22 mol 219 unq 4 iso 0 dist 6.65093 10.9246 6.12768 5.05436 6.44817 8.8527 numMergedOcc 0
23 mol 219 unq 5 iso 0 dist 6.65093 10.9246 6.12768 15.414 9.36547 11.1178 numMergedOcc 0
24 mol 219 unq 6 iso 0 dist 6.65093 13.5876 7.19159 5.05436 6.44817 11.4193 numMergedOcc 0
25 mol 219 unq 7 iso 0 dist 6.65093 13.5876 7.19159 15.414 9.36547 4.72332 numMergedOcc 0
26 mol 219 unq 8 iso 0 dist 9.93514 11.5979 7.68645 15.7107 6.44817 11.3569 numMergedOcc 0
27 mol 219 unq 9 iso 0 dist 9.93514 11.5979 7.68645 5.01588 9.36547 9.13819 numMergedOcc 0
28 mol 219 unq 10 iso 0 dist 9.93514 14.2005 5.75017 15.7107 6.44817 4.78402 numMergedOcc 0
29 mol 219 unq 11 iso 0 dist 9.93514 14.2005 5.75017 5.01588 9.36547 11.6561 numMergedOcc 0
30 mol 219 unq 12 iso 0 dist 9.93514 10.1098 6.12768 15.7107 6.44817 8.8527 numMergedOcc 0
31 mol 219 unq 13 iso 0 dist 9.93514 10.1098 6.12768 5.01588 9.36547 11.1178 numMergedOcc 0
32 mol 219 unq 14 iso 0 dist 9.93514 5.49378 7.19159 15.7107 6.44817 11.4193 numMergedOcc 0
33 mol 219 unq 15 iso 0 dist 9.93514 5.49378 7.19159 5.01588 9.36547 4.72332 numMergedOcc 0
34 mol 229 unq 0 iso 0 dist 6.54801 4.84291 6.51465 10.6892 8.34954 6.62766 numMergedOcc 0
35 mol 229 unq 1 iso 0 dist 6.54801 4.84291 6.51465 8.19789 9.27328 6.03803 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 9.64024 11.2259 9.15503 6.22327 9.48877 10.7217 numMergedOcc 0
37 mol 283 unq 0 iso 0 dist 5.7378 5.91336 8.25636 12.1132 8.47034 9.63618 numMergedOcc 0
38 mol 283 unq 1 iso 0 dist 5.7378 5.91336 8.25636 10.167 8.57491 9.82243 numMergedOcc 0
39 mol 283 unq 2 iso 0 dist 7.15632 12.4228 8.25636 8.90736 8.47034 9.63618 numMergedOcc 0
40 mol 283 unq 3 iso 0 dist 7.15632 12.4228 8.25636 5.80649 8.57491 9.82243 numMergedOcc 0
41 mol 285 unq 0 iso 0 dist 8.45077 9.453 8.89057 12.7475 5.087 10.3198 numMergedOcc 0
42 mol 285 unq 1 iso 0 dist 8.45077 14.5796 7.97266 12.7475 5.087 5.26233 numMergedOcc 0
