0 mol 7 unq 0 iso 0 dist 8.41173 7.38748 10.1841 6.22892 6.3027 5.0893 5.13744 10.2446 8.77133 6.36911 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.00925 8.68949 16.2669 6.92865 11.3728 8.33226 6.88402 15.3607 8.70858 8.99126 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 9.3147 8.75001 10.2713 7.84393 10.5285 12.48 6.31174 14.6162 14.362 8.73972 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 9.79426 8.75001 12.053 7.84393 9.84922 12.48 6.31174 9.04865 14.362 8.73972 numMergedOcc 0
4 mol 42 unq 0 iso 0 dist 8.84148 5.52834 5.21506 8.52254 6.73507 4.38082 6.79455 11.6888 6.51963 7.41857 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 8.36915 9.53081 13.2937 5.36645 8.03277 12.299 4.16088 10.2994 12.851 8.09058 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 6.01454 9.53081 5.41488 5.36645 9.26483 12.299 4.16088 9.18584 12.851 8.09058 numMergedOcc 0
7 mol 64 unq 0 iso 0 dist 9.3473 8.86433 12.8692 9.10915 9.82646 14.8927 12.9814 17.231 20.358 8.68586 numMergedOcc 0
8 mol 64 unq 1 iso 0 dist 6.08228 5.66803 5.88036 5.54343 5.33496 5.9853 5.68492 9.82635 5.1488 8.68586 numMergedOcc 0
9 mol 64 unq 2 iso 0 dist 9.86958 8.85416 5.88036 9.99634 10.8691 6.43864 8.21081 12.174 7.77991 9.80142 numMergedOcc 0
10 mol 64 unq 3 iso 0 dist 9.86958 8.85416 5.88036 9.99634 10.8691 6.43864 11.6323 9.82635 5.1488 9.54144 numMergedOcc 0
11 mol 69 unq 0 iso 0 dist 8.36667 8.70964 11.5923 8.24121 14.9981 6.57301 6.51655 14.7243 11.837 7.04352 numMergedOcc 0
12 mol 69 unq 1 iso 0 dist 8.36667 8.70964 11.5923 8.24121 14.9981 6.57301 15.9496 21.1392 10.4043 8.1114 numMergedOcc 0
13 mol 87 unq 0 iso 0 dist 9.10245 9.90256 5.83874 5.26938 5.39287 5.30415 7.62644 12.6881 9.53368 7.51358 numMergedOcc 0
14 mol 87 unq 1 iso 0 dist 9.10245 9.90256 5.83874 5.26938 5.39287 5.30415 10.8096 11.2241 6.54532 8.93296 numMergedOcc 0
15 mol 87 unq 2 iso 0 dist 9.10245 9.90256 5.83874 8.91602 11.6194 11.2095 7.62644 12.6881 9.53368 8.32298 numMergedOcc 0
16 mol 87 unq 3 iso 0 dist 9.10245 5.63748 7.43534 5.26938 5.39287 5.507 7.62644 12.6881 11.0056 7.51358 numMergedOcc 0
17 mol 87 unq 4 iso 0 dist 9.10245 5.63748 7.43534 5.26938 5.39287 5.507 10.8096 11.2241 14.1892 8.93296 numMergedOcc 0
18 mol 87 unq 5 iso 0 dist 9.10245 5.63748 7.43534 8.91602 11.6194 7.26523 7.62644 12.6881 11.0056 8.32298 numMergedOcc 0
19 mol 114 unq 0 iso 0 dist 9.6874 6.54778 4.84565 5.97879 8.15877 5.0333 5.84883 10.8293 6.06039 6.73814 numMergedOcc 0
20 mol 127 unq 0 iso 0 dist 8.98151 5.83719 8.21735 8.62711 6.75619 11.2447 13.376 14.869 15.4752 9.81878 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 6.47689 8.92801 7.11585 9.63295 5.16386 9.40823 10.602 10.2559 13.8176 6.93764 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 6.47689 9.40718 5.15002 9.63295 5.16386 5.32364 10.602 10.2559 9.23089 6.93764 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 7.86207 9.89039 9.09963 8.9077 4.90657 13.6952 10.4277 10.4686 18.0435 6.84247 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 7.86207 9.89039 9.09963 8.9077 4.90657 13.6952 12.6281 10.0817 17.3246 6.99002 numMergedOcc 0
25 mol 220 unq 2 iso 0 dist 7.86207 8.57174 14.3078 8.9077 4.90657 13.8822 10.4277 10.4686 15.2861 6.84247 numMergedOcc 0
26 mol 220 unq 3 iso 0 dist 7.86207 8.57174 14.3078 8.9077 4.90657 13.8822 12.6281 10.0817 13.108 6.99002 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 6.08181 8.10903 10.8957 9.67877 5.09738 13.3533 13.6436 10.1492 18.9608 6.49982 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 6.08181 7.25618 11.0025 9.67877 5.09738 15.0574 13.6436 10.1492 20.2888 6.49982 numMergedOcc 0
29 mol 258 unq 2 iso 0 dist 7.70189 8.10903 5.27718 9.67877 10.4667 13.3533 13.6436 15.2899 18.9608 6.49982 numMergedOcc 0
30 mol 258 unq 3 iso 0 dist 7.70189 7.25618 9.46467 9.67877 10.4667 15.0574 13.6436 15.2899 20.2888 6.49982 numMergedOcc 0
