0 mol 7 unq 0 iso 0 dist 9.26914 12.1468 7.10621 18.2699 9.67164 13.156 20.9442 12.2041 12.2333 5.99459 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 7.60252 7.54416 8.8178 8.34938 7.12321 4.27726 12.4898 5.36766 12.8385 9.74228 numMergedOcc 0
2 mol 72 unq 1 iso 0 dist 7.60252 7.54416 8.8178 8.34938 7.12321 4.27726 13.3874 8.24309 9.84449 6.21799 numMergedOcc 0
3 mol 72 unq 2 iso 0 dist 7.60252 9.89539 9.96708 8.34938 7.12321 7.47371 12.4898 5.36766 10.8086 9.74228 numMergedOcc 0
4 mol 72 unq 3 iso 0 dist 7.60252 9.89539 9.96708 8.34938 7.12321 7.47371 13.3874 8.24309 9.78528 6.21799 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.83265 6.69737 8.70481 13.7606 5.5087 11.2069 16.8384 8.07446 16.0098 5.61588 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.83265 6.69737 8.70481 12.8912 6.08682 10.6713 16.8384 8.07446 16.0098 7.83244 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 6.89004 11.5995 9.36773 4.02602 7.80898 12.1193 11.306 12.1547 16.8013 7.51139 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 6.12086 13.7041 9.03572 14.1258 8.27883 4.99174 11.8585 6.59884 11.5113 7.7152 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 6.12086 11.3093 8.83255 14.1258 8.27883 8.67311 11.8585 6.59884 12.9844 7.7152 numMergedOcc 0
10 mol 95 unq 2 iso 0 dist 6.12086 4.98369 8.03644 14.1258 8.27883 15.6249 11.8585 6.59884 11.3446 7.7152 numMergedOcc 0
11 mol 95 unq 3 iso 0 dist 7.93544 11.3277 9.03572 11.9393 8.27883 4.99174 12.7348 6.59884 11.5113 7.7152 numMergedOcc 0
12 mol 95 unq 4 iso 0 dist 7.93544 5.822 8.83255 11.9393 8.27883 8.67311 12.7348 6.59884 12.9844 7.7152 numMergedOcc 0
13 mol 95 unq 5 iso 0 dist 7.93544 9.11942 8.03644 11.9393 8.27883 15.6249 12.7348 6.59884 11.3446 7.7152 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 7.86754 8.48326 8.69985 4.89867 8.52024 5.00433 7.70586 7.15843 13.1098 9.89083 numMergedOcc 0
15 mol 112 unq 0 iso 0 dist 5.43031 5.21064 7.71338 8.3383 8.47988 6.95317 9.23352 4.8896 11.5121 9.02706 numMergedOcc 0
16 mol 112 unq 1 iso 0 dist 5.43031 5.21064 7.71338 5.07427 8.0427 7.57713 9.23352 4.8896 11.5121 9.39168 numMergedOcc 0
17 mol 132 unq 0 iso 0 dist 8.54009 4.98777 7.7059 11.0981 6.89918 12.9631 12.5891 4.35917 11.5751 7.89457 numMergedOcc 0
18 mol 142 unq 0 iso 0 dist 6.90378 8.11604 9.2313 9.67929 7.81207 4.67662 7.01955 5.32922 5.31024 6.14151 numMergedOcc 0
19 mol 142 unq 1 iso 0 dist 6.90378 5.39629 7.73169 9.67929 7.81207 5.81599 7.01955 5.32922 7.26382 6.14151 numMergedOcc 0
20 mol 142 unq 2 iso 0 dist 6.90378 5.4779 8.96657 9.67929 7.81207 11.1 7.01955 5.32922 11.0824 6.14151 numMergedOcc 0
21 mol 142 unq 3 iso 0 dist 7.01955 8.11604 5.31024 9.67929 6.14151 4.67662 6.90378 5.32922 9.2313 7.81207 numMergedOcc 0
22 mol 142 unq 4 iso 0 dist 7.01955 5.39629 7.26382 9.67929 6.14151 5.81599 6.90378 5.32922 7.73169 7.81207 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 9.07855 15.5856 7.46176 11.2726 5.85442 10.067 17.0564 9.98105 12.0576 6.9899 numMergedOcc 0
24 mol 259 unq 1 iso 0 dist 9.07855 15.5856 7.46176 9.26271 6.95511 11.6988 9.85796 6.96053 7.88519 9.46361 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 8.61945 9.21781 9.7748 15.9144 8.9682 17.6038 17.6016 11.8268 21.4606 9.57499 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 8.61945 9.21781 9.7748 15.9144 8.9682 17.6038 12.0954 7.08227 16.3537 5.46926 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 8.61945 9.21781 9.7748 13.156 6.92711 14.772 12.0954 7.08227 16.3537 5.13913 numMergedOcc 0
