0 mol 7 unq 0 iso 0 dist 9.90117 6.96396 7.21217 11.1727 5.07985 6.1206 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.90117 6.96396 7.21217 13.8869 6.83196 7.67927 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.88676 5.66097 5.84479 12.8674 6.04677 8.43054 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 5.86972 7.46414 9.23576 4.74069 4.57886 7.26639 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 5.44539 6.33921 5.38191 9.38598 5.60003 7.16132 numMergedOcc 0
5 mol 108 unq 0 iso 0 dist 9.32474 5.60268 7.29462 12.8724 11.975 7.93045 numMergedOcc 0
6 mol 108 unq 1 iso 0 dist 8.80334 5.60268 5.4057 12.8724 6.84497 7.93045 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 8.59182 12.4009 8.21889 17.2736 10.4255 6.29161 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 8.59182 12.4009 8.21889 18.3991 14.5244 7.86666 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.24549 4.99061 6.49205 10.7143 8.22696 8.95212 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 7.07421 4.80675 6.29026 8.85652 4.79473 5.51197 numMergedOcc 0
11 mol 129 unq 1 iso 0 dist 7.07421 4.80675 6.29026 9.31543 5.04019 6.69691 numMergedOcc 0
12 mol 129 unq 2 iso 0 dist 7.07421 4.80675 6.29026 12.172 10.1802 8.86944 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 5.59682 6.62991 8.89982 9.17216 9.0696 6.59889 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 5.59682 6.62991 8.89982 9.44172 9.83062 8.9192 numMergedOcc 0
15 mol 152 unq 2 iso 0 dist 7.71277 7.17016 8.89982 9.40483 9.0696 6.59889 numMergedOcc 0
16 mol 152 unq 3 iso 0 dist 7.71277 7.17016 8.89982 12.3659 9.83062 8.9192 numMergedOcc 0
17 mol 178 unq 0 iso 0 dist 8.14441 13.6129 8.0974 17.8568 9.80877 9.11204 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 6.47689 4.681 6.43406 8.39573 5.71744 5.05973 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 8.94671 4.85077 7.86625 8.8774 4.82437 9.56028 numMergedOcc 0
20 mol 206 unq 0 iso 0 dist 8.63033 9.19627 6.97859 11.7464 5.84459 9.21377 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 9.81136 17.404 8.49704 10.1284 4.112 7.46481 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 7.47122 15.4433 9.75313 8.57781 3.56689 8.08349 numMergedOcc 0
23 mol 224 unq 1 iso 0 dist 5.97988 6.70321 6.08709 14.4359 11.4272 8.08349 numMergedOcc 0
24 mol 224 unq 2 iso 0 dist 6.6537 4.55824 9.75313 5.36326 3.56689 8.08349 numMergedOcc 0
25 mol 224 unq 3 iso 0 dist 9.08719 4.55824 6.08709 5.36326 11.4272 8.08349 numMergedOcc 0
26 mol 235 unq 0 iso 0 dist 7.99218 10.3775 7.2346 10.2111 5.39025 5.1823 numMergedOcc 0
27 mol 235 unq 1 iso 0 dist 7.99218 10.3775 7.2346 11.57 4.3433 5.70635 numMergedOcc 0
28 mol 236 unq 0 iso 0 dist 9.13126 5.52669 9.10613 9.67162 4.8226 8.23087 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 5.57184 7.01206 5.24313 9.67281 12.4194 9.12776 numMergedOcc 0
30 mol 238 unq 1 iso 0 dist 6.74214 6.3873 9.31417 14.5078 13.338 9.72188 numMergedOcc 0
31 mol 238 unq 2 iso 0 dist 5.33462 6.3873 5.56719 14.5078 12.046 9.72188 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 8.73077 13.6207 6.77279 18.4793 9.90573 9.07743 numMergedOcc 0
33 mol 259 unq 1 iso 0 dist 8.73077 16.6797 9.58006 18.1212 12.7528 9.63573 numMergedOcc 0
34 mol 259 unq 2 iso 0 dist 8.73077 16.6797 9.58006 18.4793 9.90573 7.66153 numMergedOcc 0
35 mol 259 unq 3 iso 0 dist 6.76656 10.908 6.77279 15.148 9.90573 9.07743 numMergedOcc 0
36 mol 259 unq 4 iso 0 dist 6.76656 12.7595 9.58006 13.0667 12.7528 9.63573 numMergedOcc 0
37 mol 259 unq 5 iso 0 dist 6.76656 12.7595 9.58006 15.148 9.90573 7.66153 numMergedOcc 0
38 mol 259 unq 6 iso 0 dist 9.45077 8.63445 7.93997 13.113 7.06301 5.85442 numMergedOcc 0
39 mol 259 unq 7 iso 0 dist 9.45077 8.63445 7.93997 13.7343 7.80863 6.95511 numMergedOcc 0
40 mol 259 unq 8 iso 0 dist 4.55368 6.18571 7.93997 8.40328 7.06301 5.85442 numMergedOcc 0
41 mol 259 unq 9 iso 0 dist 4.55368 6.18571 7.93997 8.2518 7.80863 6.95511 numMergedOcc 0
42 mol 277 unq 0 iso 0 dist 6.23539 6.16829 9.02914 11.2458 13.3706 5.46926 numMergedOcc 0
43 mol 277 unq 1 iso 0 dist 6.23539 6.16829 9.02914 9.4543 12.1739 5.13913 numMergedOcc 0
44 mol 277 unq 2 iso 0 dist 6.23539 7.44724 6.90434 13.9062 8.51268 9.35539 numMergedOcc 0
45 mol 277 unq 3 iso 0 dist 6.23539 7.44724 6.90434 11.2458 13.3706 8.9682 numMergedOcc 0
46 mol 277 unq 4 iso 0 dist 6.23539 7.44724 6.90434 9.4543 12.1739 6.92711 numMergedOcc 0
47 mol 280 unq 0 iso 0 dist 7.3304 7.26698 8.85762 11.3818 7.42656 6.86234 numMergedOcc 0
48 mol 285 unq 0 iso 0 dist 4.74716 5.93692 8.71213 13.1783 13.9922 7.80862 numMergedOcc 0
