0 mol 26 unq 0 iso 0 dist 6.84751 4.25444 6.79475 9.59446 6.64374 6.15893 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.84751 4.25444 6.79475 8.01238 5.39199 5.497 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.887 9.12499 8.38156 12.1588 10.4006 8.90835 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 7.93454 14.28 7.79336 14.1478 7.68459 8.90835 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 9.06898 14.28 7.08559 14.1478 5.70782 8.90835 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 6.89527 4.39526 8.96498 7.98453 5.26394 9.0008 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.18572 8.36307 9.4866 11.2779 10.1364 7.03226 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 5.44426 11.4327 6.61111 8.33845 3.94967 6.0129 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 8.65429 13.0095 4.44979 10.0453 3.92737 6.0129 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 9.21978 5.39389 8.0168 12.9167 10.3264 7.70313 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 9.26505 5.26498 7.65255 9.19273 6.44969 7.52142 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 7.33743 12.7763 8.55349 15.0248 11.4316 7.41399 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 7.33743 12.7763 8.55349 13.7203 12.3375 8.21165 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 7.33743 12.7763 8.55349 9.68996 4.10674 8.97945 numMergedOcc 0
14 mol 133 unq 3 iso 0 dist 7.33743 12.7763 8.55349 12.2194 6.24625 9.50664 numMergedOcc 0
15 mol 133 unq 4 iso 0 dist 7.33743 12.7763 8.55349 13.2036 6.11861 6.71555 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 9.8564 8.67365 7.43401 11.4228 6.93712 8.55616 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 7.37418 4.45088 5.06715 11.0346 5.23961 8.84087 numMergedOcc 0
18 mol 134 unq 2 iso 0 dist 7.37418 6.30166 6.14686 11.0346 5.23961 6.32615 numMergedOcc 0
19 mol 134 unq 3 iso 0 dist 7.37418 9.11519 8.22942 11.0346 5.23961 7.73791 numMergedOcc 0
20 mol 134 unq 4 iso 0 dist 7.37418 12.9231 8.50502 11.0346 5.23961 6.75145 numMergedOcc 0
21 mol 134 unq 5 iso 0 dist 7.37418 11.4833 6.68164 11.0346 5.23961 8.1856 numMergedOcc 0
22 mol 134 unq 6 iso 0 dist 9.13631 6.15672 5.52149 12.8792 6.06606 6.93279 numMergedOcc 0
23 mol 157 unq 0 iso 0 dist 8.51753 6.83479 6.4431 11.1288 3.89036 6.455 numMergedOcc 0
24 mol 173 unq 0 iso 0 dist 5.82174 9.00192 6.52508 13.1046 11.2063 8.41245 numMergedOcc 0
25 mol 173 unq 1 iso 0 dist 5.82174 9.00192 6.52508 6.07708 4.60149 6.64779 numMergedOcc 0
26 mol 181 unq 0 iso 0 dist 7.83476 12.188 9.09234 8.83185 4.98436 7.05653 numMergedOcc 0
27 mol 186 unq 0 iso 0 dist 5.00402 4.32025 7.25339 7.77211 3.87082 8.97471 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 6.39499 6.40261 8.27411 12.7701 11.1693 7.43663 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 9.65996 6.33111 6.1905 11.2841 3.92782 5.7131 numMergedOcc 0
30 mol 292 unq 1 iso 0 dist 9.13412 6.33111 5.84792 11.2841 5.93687 5.7131 numMergedOcc 0
