0 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 8.59466 7.36323 12.3067 10.2624 4.82629 6.6219 11.0181 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 7.40392 8.23069 5.54419 8.59466 7.36323 12.3067 13.5967 10.1698 5.68215 17.003 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 7.40392 8.59466 7.36323 8.23069 5.54419 12.3067 13.1831 6.28159 8.87744 10.4135 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 7.40392 8.59466 7.36323 8.23069 5.54419 12.3067 11.0243 5.50396 7.27472 9.33482 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.06275 5.5249 8.80331 10.4413 6.20293 8.13395 8.74209 5.41726 6.6263 6.75943 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.06275 10.4413 6.20293 5.5249 8.80331 8.13395 8.74209 5.41726 6.75943 6.6263 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 8.90024 13.9129 8.80331 5.84171 6.20293 8.13395 10.8355 5.41726 6.6263 6.75943 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 8.90024 5.84171 6.20293 13.9129 8.80331 8.13395 10.8355 5.41726 6.75943 6.6263 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.43143 16.2349 9.96708 10.5786 8.8178 10.7394 13.9281 5.69391 9.55118 13.6019 numMergedOcc 0
9 mol 72 unq 1 iso 0 dist 9.43143 16.2349 9.96708 10.5786 8.8178 10.7394 22.0093 13.4212 9.10345 18.0706 numMergedOcc 0
10 mol 72 unq 2 iso 0 dist 5.48831 13.0773 9.96708 10.5933 9.78528 8.24309 11.3204 7.47371 7.12321 6.21799 numMergedOcc 0
11 mol 72 unq 3 iso 0 dist 5.48831 10.5933 9.78528 13.0773 9.96708 8.24309 11.3204 7.47371 6.21799 7.12321 numMergedOcc 0
12 mol 72 unq 4 iso 0 dist 5.48831 10.5933 9.78528 13.0773 9.96708 8.24309 12.3271 9.67587 5.03251 9.35457 numMergedOcc 0
13 mol 72 unq 5 iso 0 dist 5.48831 10.5933 9.78528 13.0773 9.96708 8.24309 9.20886 7.07356 7.66093 12.1131 numMergedOcc 0
14 mol 85 unq 0 iso 0 dist 9.9795 13.0232 6.19965 9.53239 7.97049 5.42586 13.066 4.41789 7.7068 10.2413 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 9.8079 5.182 7.4729 10.571 6.82344 8.95922 10.3799 4.46885 8.3773 11.1432 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 8.3558 15.1474 7.4729 8.66262 6.82344 8.95922 11.6676 4.46885 8.3773 11.1432 numMergedOcc 0
17 mol 95 unq 0 iso 0 dist 6.86713 9.70895 8.03644 10.3731 9.03572 16.6055 16.0926 11.3215 9.3948 19.7448 numMergedOcc 0
18 mol 95 unq 1 iso 0 dist 6.86713 9.70895 8.03644 10.3731 9.03572 16.6055 11.392 5.06946 9.74607 11.97 numMergedOcc 0
19 mol 95 unq 2 iso 0 dist 6.86713 9.70895 8.03644 7.4052 8.83255 13.8105 16.0926 11.3215 9.3948 19.9408 numMergedOcc 0
20 mol 95 unq 3 iso 0 dist 6.86713 9.70895 8.03644 7.4052 8.83255 13.8105 11.392 5.06946 9.74607 13.5721 numMergedOcc 0
21 mol 98 unq 0 iso 0 dist 9.83528 12.3158 5.08437 15.1765 6.48948 9.51923 11.8912 3.9764 5.10496 5.92242 numMergedOcc 0
22 mol 98 unq 1 iso 0 dist 9.83528 12.3158 5.08437 8.06684 6.10456 8.40073 11.8912 3.9764 5.10496 5.2571 numMergedOcc 0
23 mol 98 unq 2 iso 0 dist 9.83528 15.1765 6.48948 12.3158 5.08437 9.51923 11.8912 3.9764 5.92242 5.10496 numMergedOcc 0
24 mol 98 unq 3 iso 0 dist 9.83528 15.1765 6.48948 12.3158 5.08437 9.51923 15.0815 7.03983 7.02507 9.89095 numMergedOcc 0
25 mol 98 unq 4 iso 0 dist 9.83528 15.1765 6.48948 8.06684 6.10456 9.42358 11.8912 3.9764 5.92242 5.2571 numMergedOcc 0
26 mol 98 unq 5 iso 0 dist 9.83528 15.1765 6.48948 8.06684 6.10456 9.42358 15.0815 7.03983 7.02507 12.7417 numMergedOcc 0
27 mol 98 unq 6 iso 0 dist 9.83528 8.06684 6.10456 12.3158 5.08437 8.40073 15.2524 10.4782 7.54889 9.81956 numMergedOcc 0
28 mol 98 unq 7 iso 0 dist 9.83528 8.06684 6.10456 12.3158 5.08437 8.40073 11.8912 3.9764 5.2571 5.10496 numMergedOcc 0
29 mol 98 unq 8 iso 0 dist 9.83528 8.06684 6.10456 15.1765 6.48948 9.42358 15.2524 10.4782 7.54889 10.8223 numMergedOcc 0
30 mol 98 unq 9 iso 0 dist 9.83528 8.06684 6.10456 15.1765 6.48948 9.42358 11.8912 3.9764 5.2571 5.92242 numMergedOcc 0
31 mol 98 unq 10 iso 0 dist 7.54969 11.7493 5.08437 10.3366 6.48948 9.51923 8.79016 3.9764 5.10496 5.92242 numMergedOcc 0
32 mol 98 unq 11 iso 0 dist 7.54969 11.7493 5.08437 5.15322 6.10456 8.40073 8.79016 3.9764 5.10496 5.2571 numMergedOcc 0
33 mol 98 unq 12 iso 0 dist 7.54969 10.3366 6.48948 11.7493 5.08437 9.51923 8.79016 3.9764 5.92242 5.10496 numMergedOcc 0
34 mol 98 unq 13 iso 0 dist 7.54969 10.3366 6.48948 11.7493 5.08437 9.51923 12.3426 7.03983 7.02507 9.89095 numMergedOcc 0
35 mol 98 unq 14 iso 0 dist 7.54969 10.3366 6.48948 5.15322 6.10456 9.42358 8.79016 3.9764 5.92242 5.2571 numMergedOcc 0
36 mol 98 unq 15 iso 0 dist 7.54969 10.3366 6.48948 5.15322 6.10456 9.42358 12.3426 7.03983 7.02507 12.7417 numMergedOcc 0
37 mol 98 unq 16 iso 0 dist 7.54969 5.15322 6.10456 11.7493 5.08437 8.40073 12.301 10.4782 7.54889 9.81956 numMergedOcc 0
38 mol 98 unq 17 iso 0 dist 7.54969 5.15322 6.10456 11.7493 5.08437 8.40073 8.79016 3.9764 5.2571 5.10496 numMergedOcc 0
39 mol 98 unq 18 iso 0 dist 7.54969 5.15322 6.10456 10.3366 6.48948 9.42358 12.301 10.4782 7.54889 10.8223 numMergedOcc 0
40 mol 98 unq 19 iso 0 dist 7.54969 5.15322 6.10456 10.3366 6.48948 9.42358 8.79016 3.9764 5.2571 5.92242 numMergedOcc 0
41 mol 133 unq 0 iso 0 dist 7.5055 10.9541 8.22656 5.61003 6.82262 5.61668 10.7738 4.88025 8.26547 9.05342 numMergedOcc 0
42 mol 133 unq 1 iso 0 dist 7.5055 5.61003 6.82262 10.9541 8.22656 5.61668 10.7738 4.88025 9.05342 8.26547 numMergedOcc 0
43 mol 134 unq 0 iso 0 dist 8.84656 10.879 6.37586 16.7911 9.71307 6.81259 14.395 10.8635 9.33094 8.69531 numMergedOcc 0
44 mol 134 unq 1 iso 0 dist 8.84656 16.7911 9.71307 10.879 6.37586 6.81259 18.4308 15.0225 9.1998 11.0808 numMergedOcc 0
45 mol 134 unq 2 iso 0 dist 8.84656 16.7911 9.71307 10.879 6.37586 6.81259 14.395 10.8635 8.69531 9.33094 numMergedOcc 0
46 mol 134 unq 3 iso 0 dist 4.9155 10.879 6.49416 9.30817 6.54501 5.00526 14.395 12.3479 9.33094 11.2896 numMergedOcc 0
47 mol 134 unq 4 iso 0 dist 8.49987 10.9399 6.49416 6.47843 6.54501 5.00526 14.5869 12.3479 9.33094 11.2896 numMergedOcc 0
48 mol 134 unq 5 iso 0 dist 9.42271 7.07625 6.49416 6.16353 6.54501 5.00526 6.14652 12.3479 9.33094 11.2896 numMergedOcc 0
49 mol 134 unq 6 iso 0 dist 5.79157 13.0109 9.86662 14.1608 9.71307 5.49782 8.8437 4.00092 7.21868 7.93372 numMergedOcc 0
50 mol 134 unq 7 iso 0 dist 5.79157 14.1608 9.71307 13.0109 9.86662 5.49782 14.4761 10.2026 9.33924 13.9752 numMergedOcc 0
51 mol 134 unq 8 iso 0 dist 5.79157 14.1608 9.71307 13.0109 9.86662 5.49782 8.8437 4.00092 7.93372 7.21868 numMergedOcc 0
52 mol 152 unq 0 iso 0 dist 8.34839 5.65129 8.56324 10.5295 6.70283 7.65448 9.4275 5.39112 6.59889 6.70693 numMergedOcc 0
53 mol 152 unq 1 iso 0 dist 8.34839 5.65129 8.56324 10.5295 6.70283 7.65448 9.83462 4.84714 8.9192 9.27706 numMergedOcc 0
54 mol 152 unq 2 iso 0 dist 8.34839 5.65129 8.56324 10.7929 7.16148 10.6875 9.4275 5.39112 6.59889 10.4895 numMergedOcc 0
55 mol 152 unq 3 iso 0 dist 8.34839 5.65129 8.56324 10.7929 7.16148 10.6875 9.83462 4.84714 8.9192 11.6735 numMergedOcc 0
56 mol 152 unq 4 iso 0 dist 8.34839 10.5295 6.70283 5.65129 8.56324 7.65448 9.4275 5.39112 6.70693 6.59889 numMergedOcc 0
57 mol 152 unq 5 iso 0 dist 8.34839 10.5295 6.70283 10.7929 7.16148 5.49936 9.4275 5.39112 6.70693 10.4895 numMergedOcc 0
58 mol 178 unq 0 iso 0 dist 8.04723 14.4072 6.69288 13.0519 6.43573 5.34677 10.9114 6.42973 7.06025 10.0638 numMergedOcc 0
59 mol 178 unq 1 iso 0 dist 8.04723 14.4072 6.69288 10.5681 7.17202 11.7381 10.9114 6.42973 7.06025 13.2692 numMergedOcc 0
60 mol 178 unq 2 iso 0 dist 8.04723 14.4072 6.69288 9.1499 8.81551 14.0703 10.9114 6.42973 7.06025 15.0672 numMergedOcc 0
61 mol 229 unq 0 iso 0 dist 6.88694 6.52416 7.03423 11.1919 9.06952 6.84129 9.90415 7.22525 7.27993 11.9869 numMergedOcc 0
62 mol 236 unq 0 iso 0 dist 8.95071 12.8358 6.27581 18.4732 9.99038 7.28249 14.8517 10.5774 9.3206 10.1317 numMergedOcc 0
63 mol 238 unq 0 iso 0 dist 8.97461 11.6506 7.31233 10.4685 6.22714 5.34096 18.2277 10.3162 9.12776 8.69015 numMergedOcc 0
64 mol 248 unq 0 iso 0 dist 7.40475 7.63032 7.69895 6.42334 7.21521 5.55137 11.6204 4.58289 9.05018 9.33962 numMergedOcc 0
65 mol 248 unq 1 iso 0 dist 7.40475 7.63032 7.69895 6.86606 8.2965 10.8081 11.6204 4.58289 9.05018 11.4547 numMergedOcc 0
