0 mol 14 unq 0 iso 0 dist 8.64855 15.5387 9.58196 11.8313 4.53725 9.04767 18.16 13.1379 10.3326 9.31271 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 9.9795 9.53239 7.97049 11.5591 6.9948 7.47541 14.2838 13.2962 11.609 6.56728 numMergedOcc 0
2 mol 85 unq 1 iso 0 dist 9.9795 13.0232 6.19965 11.5591 6.9948 7.66905 14.2838 13.2962 13.5384 6.56728 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 9.23803 6.32175 8.58044 11.1563 7 7.34473 9.21495 11.8872 5.29855 7.51061 numMergedOcc 0
4 mol 109 unq 1 iso 0 dist 8.05028 6.32175 9.97763 11.1563 8.40993 7.34473 9.21495 10.7963 5.29855 7.51061 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.94179 6.70853 9.52634 12.2738 7.6656 7.24514 16.375 16.8376 10.0277 9.79004 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 4.68975 9.30817 9.89303 4.9155 5.79898 6.54501 9.86688 11.3191 7.41837 5.57904 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 8.84656 10.879 6.37586 4.9155 5.00817 6.49416 9.86688 7.27598 6.50005 5.57904 numMergedOcc 0
8 mol 134 unq 2 iso 0 dist 4.9155 10.879 6.49416 8.84656 5.00817 6.37586 9.86688 5.57904 6.50005 7.27598 numMergedOcc 0
9 mol 134 unq 3 iso 0 dist 8.49987 10.9399 6.49416 13.0189 5.00817 6.37586 11.3888 5.57904 6.50005 7.27598 numMergedOcc 0
10 mol 134 unq 4 iso 0 dist 9.42271 7.07625 6.49416 10.5814 5.00817 6.37586 12.3347 5.57904 6.50005 7.27598 numMergedOcc 0
11 mol 142 unq 0 iso 0 dist 8.86346 16.7609 9.2313 13.95 5.32922 5.31024 17.4428 10.9228 6.3846 9.14908 numMergedOcc 0
12 mol 142 unq 1 iso 0 dist 8.86346 13.5268 7.73169 13.95 5.32922 7.26382 17.4428 10.9228 4.39297 9.14908 numMergedOcc 0
13 mol 142 unq 2 iso 0 dist 4.93681 12.8283 9.2313 9.86383 5.32922 5.31024 14.1123 10.9228 6.3846 9.14908 numMergedOcc 0
14 mol 142 unq 3 iso 0 dist 4.93681 10.1677 7.73169 9.86383 5.32922 7.26382 14.1123 10.9228 4.39297 9.14908 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.25882 9.40714 7.80463 16.4532 13.8543 7.26832 18.6687 17.5925 10.6362 6.15806 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 7.88846 6.17038 7.54212 10.9296 6.8425 6.00706 7.13239 8.5834 5.01062 8.7419 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 8.14754 7.43271 5.81334 10.5219 5.60236 5.78342 11.3928 7.75485 5.99647 9.73411 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 8.14754 7.43271 5.81334 10.5219 5.60236 5.78342 7.10298 9.11052 5.44863 7.07564 numMergedOcc 0
19 mol 229 unq 0 iso 0 dist 6.32302 6.52416 8.22528 6.88694 5.57838 7.03423 5.75801 8.8557 5.65373 5.00457 numMergedOcc 0
20 mol 229 unq 1 iso 0 dist 6.88694 6.52416 7.03423 6.32302 5.57838 8.22528 5.75801 5.00457 5.65373 8.8557 numMergedOcc 0
21 mol 229 unq 2 iso 0 dist 8.53615 6.81165 8.22528 11.0334 5.57838 7.03423 11.8915 8.8557 5.65373 5.00457 numMergedOcc 0
