0 mol 0 unq 0 iso 0 dist 9.23213 7.40865 9.30151 5.24778 8.34244 10.4616 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 6.36911 9.68596 13.0969 5.03847 9.97624 6.14469 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 9.53002 4.30695 11.9464 10.9183 8.73067 13.8519 numMergedOcc 0
3 mol 11 unq 1 iso 0 dist 9.53002 6.35398 7.5901 10.9183 8.73067 7.98326 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 9.29358 5.89412 6.19131 9.75966 6.50647 6.03257 numMergedOcc 0
5 mol 19 unq 0 iso 0 dist 6.20943 8.40416 11.4087 10.943 9.85134 19.1389 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 6.20943 8.40416 11.4087 4.64838 5.82366 9.95212 numMergedOcc 0
7 mol 19 unq 2 iso 0 dist 7.82528 7.75618 11.4087 15.119 9.85134 19.1389 numMergedOcc 0
8 mol 19 unq 3 iso 0 dist 7.82528 7.75618 11.4087 4.97119 5.82366 9.95212 numMergedOcc 0
9 mol 19 unq 4 iso 0 dist 8.58657 6.41423 5.90856 13.0631 8.19695 13.4008 numMergedOcc 0
10 mol 19 unq 5 iso 0 dist 8.58657 6.41423 5.90856 7.08342 7.02548 9.95212 numMergedOcc 0
11 mol 21 unq 0 iso 0 dist 6.08338 9.06424 10.2036 10.6971 6.93185 11.0806 numMergedOcc 0
12 mol 54 unq 0 iso 0 dist 5.02241 7.21717 11.0681 4.29856 6.30987 10.7227 numMergedOcc 0
13 mol 58 unq 0 iso 0 dist 8.63333 9.92355 12.0055 10.2049 9.11258 10.2007 numMergedOcc 0
14 mol 58 unq 1 iso 0 dist 8.89374 7.68678 12.0055 5.49591 9.11258 10.2007 numMergedOcc 0
15 mol 100 unq 0 iso 0 dist 8.72704 7.38135 11.0949 10.6245 6.0652 15.5219 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 8.6355 7.80532 14.1488 5.71679 8.73604 6.40575 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 6.88137 8.73722 5.69209 6.14767 7.30946 5.41575 numMergedOcc 0
18 mol 156 unq 1 iso 0 dist 7.36119 7.30357 11.9671 5.81563 6.05323 8.21184 numMergedOcc 0
19 mol 156 unq 2 iso 0 dist 7.36119 8.61587 8.69711 5.81563 6.05323 5.9976 numMergedOcc 0
20 mol 156 unq 3 iso 0 dist 6.27641 9.4013 5.05683 5.4555 5.81122 8.37434 numMergedOcc 0
21 mol 175 unq 0 iso 0 dist 9.52634 9.39352 7.60254 6.77832 8.99988 13.4698 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 6.94688 8.90963 4.43678 6.6251 9.06217 12.1629 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 6.71012 8.90963 6.03415 6.6251 7.13252 12.1629 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 7.13543 9.72611 14.6648 5.77299 6.32777 15.3124 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 7.13543 7.99195 7.23063 5.77299 6.32777 8.86197 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 7.98142 5.94469 8.93991 5.63555 5.97685 10.3104 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 7.37327 5.94469 5.35588 5.63555 8.9289 10.3104 numMergedOcc 0
28 mol 181 unq 6 iso 0 dist 4.93785 9.39829 7.30555 7.77758 7.05653 11.8933 numMergedOcc 0
29 mol 194 unq 0 iso 0 dist 5.48258 8.29382 4.79043 7.11753 8.52969 12.3845 numMergedOcc 0
30 mol 194 unq 1 iso 0 dist 5.48258 6.72379 4.26755 7.11753 8.52969 6.38324 numMergedOcc 0
31 mol 232 unq 0 iso 0 dist 7.07392 8.50102 10.9886 6.2188 7.10413 9.78181 numMergedOcc 0
32 mol 235 unq 0 iso 0 dist 5.65339 6.21292 7.96337 7.77516 6.54825 6.94789 numMergedOcc 0
33 mol 235 unq 1 iso 0 dist 5.65339 6.95126 4.29892 7.77516 6.54825 10.7602 numMergedOcc 0
34 mol 235 unq 2 iso 0 dist 9.58736 9.55668 13.128 15.6327 7.31773 17.8712 numMergedOcc 0
35 mol 235 unq 3 iso 0 dist 9.43058 9.21736 17.5445 10.632 7.31773 18.395 numMergedOcc 0
36 mol 235 unq 4 iso 0 dist 6.98084 8.69356 11.921 6.82855 7.31773 14.3946 numMergedOcc 0
37 mol 238 unq 0 iso 0 dist 6.05141 8.94014 11.5793 10.7081 8.09718 10.6756 numMergedOcc 0
38 mol 238 unq 1 iso 0 dist 6.05141 8.94014 11.5793 5.50308 6.73446 5.92374 numMergedOcc 0
39 mol 238 unq 2 iso 0 dist 8.14172 7.02333 4.38002 12.2874 8.90076 10.6756 numMergedOcc 0
40 mol 238 unq 3 iso 0 dist 8.14172 7.02333 4.38002 7.11984 6.62002 5.92374 numMergedOcc 0
41 mol 238 unq 4 iso 0 dist 8.09066 7.02333 11.5793 12.2874 8.09718 10.6756 numMergedOcc 0
42 mol 238 unq 5 iso 0 dist 8.09066 7.02333 11.5793 7.11984 6.73446 5.92374 numMergedOcc 0
43 mol 238 unq 6 iso 0 dist 6.77463 8.67864 4.38002 10.4017 8.90076 10.6756 numMergedOcc 0
44 mol 238 unq 7 iso 0 dist 6.77463 8.67864 4.38002 7.95232 6.62002 5.92374 numMergedOcc 0
45 mol 238 unq 8 iso 0 dist 7.2766 8.67864 11.5793 10.4017 8.09718 10.6756 numMergedOcc 0
46 mol 238 unq 9 iso 0 dist 7.2766 8.67864 11.5793 7.95232 6.73446 5.92374 numMergedOcc 0
47 mol 264 unq 0 iso 0 dist 9.0012 7.16853 9.76317 7.52936 5.91213 10.3854 numMergedOcc 0
48 mol 264 unq 1 iso 0 dist 9.5784 7.16853 13.9064 7.52936 7.34094 10.3854 numMergedOcc 0
49 mol 274 unq 0 iso 0 dist 9.19234 9.45514 12.625 5.64601 9.20749 10.083 numMergedOcc 0
50 mol 274 unq 1 iso 0 dist 9.19234 6.39866 4.60275 5.64601 9.20749 9.16942 numMergedOcc 0
51 mol 284 unq 0 iso 0 dist 4.86729 6.78191 6.76453 4.50325 6.61376 7.34931 numMergedOcc 0
