0 mol 8 unq 0 iso 0 dist 8.68949 6.92865 8.33226 8.89145 13.2274 8.02605 6.88402 8.70858 8.99126 14.849 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 8.75001 7.84393 12.48 7.78708 5.18509 8.01051 6.31174 14.362 8.73972 12.3782 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.86433 9.10915 14.8927 7.02352 6.15294 9.21892 12.9814 20.358 8.68586 15.6843 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 8.70964 8.24121 6.57301 8.52371 10.2661 10.149 6.51655 11.837 7.04352 10.5996 numMergedOcc 0
4 mol 69 unq 1 iso 0 dist 8.70964 8.24121 6.57301 8.52371 10.2661 10.149 15.9496 10.4043 8.1114 16.9687 numMergedOcc 0
5 mol 69 unq 2 iso 0 dist 8.70964 8.24121 6.57301 6.8198 8.09841 12.0119 6.51655 11.837 7.04352 13.0654 numMergedOcc 0
6 mol 69 unq 3 iso 0 dist 8.70964 8.24121 6.57301 6.8198 8.09841 12.0119 15.9496 10.4043 8.1114 18.2373 numMergedOcc 0
7 mol 87 unq 0 iso 0 dist 9.90256 5.26938 5.30415 8.91602 11.2095 7.40574 7.62644 9.53368 7.51358 8.32298 numMergedOcc 0
8 mol 87 unq 1 iso 0 dist 9.90256 5.26938 5.30415 8.91602 11.2095 7.40574 10.8096 6.54532 8.93296 14.2495 numMergedOcc 0
9 mol 87 unq 2 iso 0 dist 9.90256 8.91602 11.2095 5.26938 5.30415 7.40574 7.62644 9.53368 8.32298 7.51358 numMergedOcc 0
10 mol 87 unq 3 iso 0 dist 5.62336 9.1329 5.507 9.33217 5.76272 10.5639 11.1364 11.0056 7.51358 16.6571 numMergedOcc 0
11 mol 87 unq 4 iso 0 dist 5.62336 9.1329 5.507 9.33217 5.76272 10.5639 16.0648 14.1892 8.93296 19.3091 numMergedOcc 0
12 mol 87 unq 5 iso 0 dist 5.62336 9.1329 5.507 9.03114 7.26523 7.40574 11.1364 11.0056 7.51358 8.32298 numMergedOcc 0
13 mol 87 unq 6 iso 0 dist 5.62336 9.1329 5.507 9.03114 7.26523 7.40574 16.0648 14.1892 8.93296 14.2495 numMergedOcc 0
14 mol 87 unq 7 iso 0 dist 5.62336 9.03114 7.26523 9.1329 5.507 7.40574 11.1364 11.0056 8.32298 7.51358 numMergedOcc 0
15 mol 87 unq 8 iso 0 dist 5.62336 9.03114 7.26523 9.33217 5.76272 11.1798 11.1364 11.0056 8.32298 16.6571 numMergedOcc 0
16 mol 87 unq 9 iso 0 dist 5.63748 5.26938 5.507 8.91602 7.26523 7.40574 7.62644 11.0056 7.51358 8.32298 numMergedOcc 0
17 mol 87 unq 10 iso 0 dist 5.63748 5.26938 5.507 8.91602 7.26523 7.40574 10.8096 14.1892 8.93296 14.2495 numMergedOcc 0
18 mol 87 unq 11 iso 0 dist 5.63748 8.91602 7.26523 5.26938 5.507 7.40574 7.62644 11.0056 8.32298 7.51358 numMergedOcc 0
19 mol 127 unq 0 iso 0 dist 5.83719 8.62711 11.2447 6.65963 4.98711 7.30196 13.376 15.4752 9.81878 11.7714 numMergedOcc 0
20 mol 132 unq 0 iso 0 dist 6.94745 6.495 5.28089 9.43748 4.50065 4.35917 10.343 10.501 6.03703 7.61505 numMergedOcc 0
21 mol 132 unq 1 iso 0 dist 6.94745 9.43748 4.50065 6.495 5.28089 4.35917 10.343 10.501 7.61505 6.03703 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 8.63249 9.97357 13.6195 6.36941 7.45579 7.28249 11.4732 10.3387 7.17676 5.34718 numMergedOcc 0
23 mol 236 unq 1 iso 0 dist 8.63249 9.97357 13.6195 6.36941 7.45579 7.28249 14.1057 14.2759 6.68463 10.5713 numMergedOcc 0
24 mol 236 unq 2 iso 0 dist 8.63249 6.36941 7.45579 9.97357 13.6195 7.28249 11.4732 10.3387 5.34718 7.17676 numMergedOcc 0
25 mol 240 unq 0 iso 0 dist 7.19218 6.83069 5.36005 9.30995 4.4564 4.28414 10.6805 10.4148 6.15305 7.03489 numMergedOcc 0
26 mol 240 unq 1 iso 0 dist 7.19218 6.83069 5.36005 9.30995 4.4564 4.28414 5.79056 11.1255 8.0951 12.1358 numMergedOcc 0
27 mol 240 unq 2 iso 0 dist 7.19218 9.30995 4.4564 6.83069 5.36005 4.28414 10.6805 10.4148 7.03489 6.15305 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 8.10903 9.67877 13.3533 8.81059 5.90131 17.2075 13.6436 18.9608 6.49982 21.9033 numMergedOcc 0
29 mol 258 unq 1 iso 0 dist 8.10903 9.67877 13.3533 9.12006 9.68064 18.4031 13.6436 18.9608 6.49982 22.7061 numMergedOcc 0
30 mol 258 unq 2 iso 0 dist 7.25618 9.67877 15.0574 8.81059 4.51422 17.2075 13.6436 20.2888 6.49982 21.9033 numMergedOcc 0
31 mol 258 unq 3 iso 0 dist 7.25618 9.67877 15.0574 9.12006 4.99997 18.4031 13.6436 20.2888 6.49982 22.7061 numMergedOcc 0
32 mol 284 unq 0 iso 0 dist 7.66585 7.32482 5.44847 7.35866 7.26724 5.87439 9.91995 13.4089 8.41504 10.0956 numMergedOcc 0
33 mol 284 unq 1 iso 0 dist 7.74965 8.08993 4.76222 7.34344 13.4636 13.5089 9.65436 11.9441 8.41504 14.711 numMergedOcc 0
34 mol 284 unq 2 iso 0 dist 7.74965 7.34344 13.4636 8.08993 4.76222 13.5089 5.83318 12.5557 4.86729 11.1846 numMergedOcc 0
