0 mol 11 unq 0 iso 0 dist 9.97185 9.91417 4.13124 4.42747 5.8689 5.56531 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.27853 9.80453 7.84827 12.4087 11.1295 9.07283 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.11977 6.45955 5.03002 5.1569 11.8684 9.50763 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 8.90417 9.94133 4.96316 4.39945 8.21723 9.64361 numMergedOcc 0
4 mol 117 unq 0 iso 0 dist 5.98822 4.60192 5.11935 5.16802 10.1014 8.03867 numMergedOcc 0
5 mol 117 unq 1 iso 0 dist 5.98822 4.60192 5.11935 4.87865 5.38954 5.94465 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 9.55462 9.91021 8.17376 8.63314 7.7267 8.42277 numMergedOcc 0
7 mol 129 unq 1 iso 0 dist 9.51379 5.5917 8.17376 4.81238 7.7267 8.42277 numMergedOcc 0
8 mol 129 unq 2 iso 0 dist 9.51379 5.24806 6.47582 4.81238 7.7267 6.26653 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 5.67578 5.55632 4.8443 4.57254 7.26891 8.50487 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 9.74021 5.23992 8.5262 9.95833 16.5723 9.81187 numMergedOcc 0
11 mol 176 unq 1 iso 0 dist 9.74021 5.23992 8.5262 3.97723 11.4538 4.67031 numMergedOcc 0
12 mol 176 unq 2 iso 0 dist 9.74021 5.23992 8.5262 6.09521 15.4558 9.49412 numMergedOcc 0
13 mol 176 unq 3 iso 0 dist 9.74021 7.91974 10.6125 9.95833 16.5723 9.71347 numMergedOcc 0
14 mol 176 unq 4 iso 0 dist 9.74021 7.91974 10.6125 3.97723 11.4538 6.20326 numMergedOcc 0
15 mol 176 unq 5 iso 0 dist 9.74021 9.1617 9.81633 9.95833 16.5723 8.77405 numMergedOcc 0
16 mol 176 unq 6 iso 0 dist 9.74021 9.1617 9.81633 3.97723 11.4538 6.8243 numMergedOcc 0
17 mol 185 unq 0 iso 0 dist 7.7352 9.62449 6.6815 4.03855 9.20346 8.60009 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 6.61361 7.39043 10.6705 4.61842 9.98753 6.23243 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.61732 9.76929 14.793 7.66679 7.90449 7.45508 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 9.19372 4.15692 8.56684 4.87406 12.6243 5.2116 numMergedOcc 0
21 mol 257 unq 0 iso 0 dist 8.04644 8.50916 7.56859 14.1389 8.42116 9.79593 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 9.62474 7.51951 10.1478 4.00824 6.55208 9.2684 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 8.01441 7.51951 8.68515 4.00824 11.9269 9.2684 numMergedOcc 0
24 mol 284 unq 0 iso 0 dist 9.5276 5.06373 4.93279 4.29335 8.45487 5.2862 numMergedOcc 0
25 mol 284 unq 1 iso 0 dist 9.5276 5.06373 4.93279 6.24981 8.72299 5.31097 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 7.64578 6.82335 10.2032 11.0879 15.9437 8.81999 numMergedOcc 0
27 mol 294 unq 1 iso 0 dist 5.85292 9.14005 10.2032 14.7951 15.9437 8.81999 numMergedOcc 0
28 mol 294 unq 2 iso 0 dist 6.28096 6.82335 5.33113 11.0879 5.02677 8.81999 numMergedOcc 0
