0 mol 21 unq 0 iso 0 dist 7.46409 13.0943 5.93898 10.5151 6.17993 9.06424 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.40189 10.212 8.87744 15.2375 9.86385 9.12854 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.22014 10.212 7.27472 15.2375 10.4353 9.12854 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 8.26412 8.64255 7.6114 16.2657 10.8122 8.6653 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 6.86485 7.71984 9.22598 8.80308 5.66912 5.93884 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 6.86485 4.67517 8.96727 8.80308 5.66912 7.68678 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 8.37546 4.67517 8.01308 8.80308 5.76523 7.68678 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 9.76234 12.5529 9.22598 12.8283 5.66912 5.93884 numMergedOcc 0
8 mol 58 unq 4 iso 0 dist 9.76234 8.47822 8.96727 12.8283 5.66912 7.68678 numMergedOcc 0
9 mol 69 unq 0 iso 0 dist 9.77648 12.4431 6.9362 13.6325 5.1678 9.97775 numMergedOcc 0
10 mol 69 unq 1 iso 0 dist 9.18161 9.69519 6.9362 13.43 5.1678 9.97775 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 5.44426 9.04817 5.10496 8.33845 3.94967 6.7117 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 5.44426 6.21302 5.2571 8.33845 3.94967 4.47349 numMergedOcc 0
13 mol 98 unq 2 iso 0 dist 5.44426 11.2075 8.7497 8.33845 3.94967 5.65185 numMergedOcc 0
14 mol 98 unq 3 iso 0 dist 8.65429 8.35877 9.64383 10.1826 12.82 7.23884 numMergedOcc 0
15 mol 98 unq 4 iso 0 dist 8.65429 9.9123 7.54889 10.0453 3.92737 4.47349 numMergedOcc 0
16 mol 98 unq 5 iso 0 dist 8.65429 8.49566 7.78931 10.0453 3.92737 5.65185 numMergedOcc 0
17 mol 100 unq 0 iso 0 dist 8.29463 5.06206 5.35782 11.7467 8.00947 7.38135 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 9.8564 12.0294 9.33094 11.4228 6.93712 6.23142 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 9.8564 14.9183 8.69531 11.4228 6.93712 9.94764 numMergedOcc 0
20 mol 181 unq 0 iso 0 dist 7.83476 5.49497 6.64173 8.83185 4.98436 5.94469 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 9.42801 15.4299 8.19317 19.3568 10.0135 8.69356 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 9.65996 6.39438 9.74118 11.2841 3.92782 9.88863 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 9.13412 14.0055 9.46442 14.3673 6.00981 8.87028 numMergedOcc 0
