0 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 12.1855 12.1296 9.87885 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.0166 6.22805 5.70161 12.2255 11.2505 9.67164 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.32945 6.22805 4.57188 12.2255 13.158 9.67164 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.90117 6.22805 6.09254 12.2255 14.899 9.67164 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 9.31149 9.04834 9.14256 5.37568 10.6183 7.65889 numMergedOcc 0
5 mol 16 unq 1 iso 0 dist 9.31149 8.17898 7.59626 5.37568 10.6183 6.42835 numMergedOcc 0
6 mol 16 unq 2 iso 0 dist 9.31149 8.17898 7.59626 9.62324 13.7566 6.57331 numMergedOcc 0
7 mol 30 unq 0 iso 0 dist 7.83595 8.37503 6.40527 10.5203 12.577 6.74179 numMergedOcc 0
8 mol 38 unq 0 iso 0 dist 5.86243 7.57586 5.39129 5.45205 8.62204 9.19165 numMergedOcc 0
9 mol 48 unq 0 iso 0 dist 8.36915 5.36645 8.03277 7.51675 15.549 9.17838 numMergedOcc 0
10 mol 48 unq 1 iso 0 dist 6.01454 5.36645 9.26483 7.51675 11.6399 9.17838 numMergedOcc 0
11 mol 54 unq 0 iso 0 dist 7.00677 6.09782 5.29727 10.763 12.1593 7.16132 numMergedOcc 0
12 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 6.24019 13.5835 9.86334 numMergedOcc 0
13 mol 64 unq 1 iso 0 dist 8.14932 8.66921 9.82646 7.01498 13.5835 9.86334 numMergedOcc 0
14 mol 64 unq 2 iso 0 dist 6.17846 8.66921 5.33496 7.01498 10.3556 9.86334 numMergedOcc 0
15 mol 64 unq 3 iso 0 dist 6.08228 5.54343 5.33496 5.18166 10.3556 9.86334 numMergedOcc 0
16 mol 68 unq 0 iso 0 dist 8.76389 5.57389 4.62335 8.95801 11.7333 7.39665 numMergedOcc 0
17 mol 73 unq 0 iso 0 dist 5.39171 6.30194 5.2774 10.7557 9.71578 8.68662 numMergedOcc 0
18 mol 73 unq 1 iso 0 dist 5.39171 6.30194 5.2774 11.1632 10.1662 7.4369 numMergedOcc 0
19 mol 73 unq 2 iso 0 dist 9.27355 6.30194 5.44275 10.7557 12.3622 8.68662 numMergedOcc 0
20 mol 73 unq 3 iso 0 dist 9.27355 6.30194 5.44275 11.1632 11.4233 7.4369 numMergedOcc 0
21 mol 73 unq 4 iso 0 dist 8.60363 6.30194 8.0624 10.7557 14.4361 8.68662 numMergedOcc 0
22 mol 73 unq 5 iso 0 dist 8.60363 6.30194 8.0624 11.1632 14.3455 7.4369 numMergedOcc 0
23 mol 88 unq 0 iso 0 dist 9.64551 9.25163 8.44462 3.42334 6.89706 7.51139 numMergedOcc 0
24 mol 114 unq 0 iso 0 dist 9.6874 5.97879 8.15877 5.33859 12.707 5.7144 numMergedOcc 0
25 mol 127 unq 0 iso 0 dist 8.98151 8.62711 6.75619 9.74982 11.4732 6.08673 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 6.68364 5.30872 5.4432 5.88056 5.44814 5.37047 numMergedOcc 0
27 mol 152 unq 0 iso 0 dist 7.53834 6.98781 7.24951 6.78963 8.61415 6.41689 numMergedOcc 0
28 mol 162 unq 0 iso 0 dist 8.954 9.42819 8.35998 8.39434 9.95076 7.37333 numMergedOcc 0
29 mol 162 unq 1 iso 0 dist 8.954 9.42819 8.35998 4.92282 7.76112 7.45998 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 7.02662 6.99623 6.3719 13.4486 13.507 9.3498 numMergedOcc 0
31 mol 217 unq 0 iso 0 dist 6.01666 9.90668 5.42652 14.2983 12.8776 9.62437 numMergedOcc 0
32 mol 219 unq 0 iso 0 dist 9.09462 9.68515 8.99881 9.32356 11.5738 4.33238 numMergedOcc 0
33 mol 219 unq 1 iso 0 dist 4.67452 8.09769 10.0509 4.74338 8.38773 4.33238 numMergedOcc 0
34 mol 219 unq 2 iso 0 dist 4.67452 7.24832 5.48556 4.74338 8.38773 7.83604 numMergedOcc 0
35 mol 223 unq 0 iso 0 dist 9.29204 9.94212 18.385 8.1388 15.6162 6.42257 numMergedOcc 0
36 mol 223 unq 1 iso 0 dist 9.29204 9.94212 18.385 14.288 23.4915 9.33543 numMergedOcc 0
37 mol 223 unq 2 iso 0 dist 9.14789 9.94212 19.0281 8.1388 16.4821 6.42257 numMergedOcc 0
38 mol 223 unq 3 iso 0 dist 9.14789 9.94212 19.0281 14.288 22.3512 9.33543 numMergedOcc 0
39 mol 223 unq 4 iso 0 dist 7.80764 9.94212 4.67731 8.1388 8.85178 6.42257 numMergedOcc 0
40 mol 223 unq 5 iso 0 dist 7.80764 9.94212 4.67731 14.288 9.73123 9.33543 numMergedOcc 0
41 mol 223 unq 6 iso 0 dist 5.75896 9.94212 7.19485 8.1388 5.50267 6.42257 numMergedOcc 0
42 mol 223 unq 7 iso 0 dist 5.75896 9.94212 7.19485 14.288 15.0085 9.33543 numMergedOcc 0
43 mol 229 unq 0 iso 0 dist 8.36396 8.0007 11.2438 6.80826 13.7271 6.95201 numMergedOcc 0
44 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 6.2559 9.11418 6.71524 numMergedOcc 0
45 mol 239 unq 0 iso 0 dist 8.34832 9.27989 11.4465 3.28983 6.64008 6.73665 numMergedOcc 0
46 mol 248 unq 0 iso 0 dist 8.11968 6.44967 4.53213 9.33595 7.90773 9.05018 numMergedOcc 0
47 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 8.41608 12.5187 9.46361 numMergedOcc 0
48 mol 264 unq 0 iso 0 dist 7.61232 6.80096 5.11257 8.11813 13.3355 9.58916 numMergedOcc 0
49 mol 276 unq 0 iso 0 dist 8.14494 5.30976 9.95911 3.87012 7.11952 8.6759 numMergedOcc 0
50 mol 279 unq 0 iso 0 dist 7.319 9.6147 13.2117 9.35656 13.7765 6.35028 numMergedOcc 0
51 mol 279 unq 1 iso 0 dist 5.78017 6.47376 5.34376 4.91802 8.9352 6.35028 numMergedOcc 0
52 mol 279 unq 2 iso 0 dist 6.12742 9.6147 5.34376 9.35656 8.9352 6.35028 numMergedOcc 0
53 mol 279 unq 3 iso 0 dist 9.45886 9.6147 10.0132 9.35656 14.3863 6.35028 numMergedOcc 0
54 mol 279 unq 4 iso 0 dist 8.78203 6.47376 5.86731 4.91802 5.8845 6.35028 numMergedOcc 0
55 mol 285 unq 0 iso 0 dist 8.08495 7.66291 8.39941 10.9224 15.6243 7.80862 numMergedOcc 0
