0 mol 4 unq 0 iso 0 dist 9.15878 7.17837 9.63758 10.6508 9.12428 9.34175 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.76585 6.95983 8.84944 10.0424 9.21978 7.95485 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 9.76585 6.95983 8.84944 12.7554 8.03754 14.9082 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 9.76585 11.3999 7.21995 10.0424 9.21978 6.80633 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 9.76585 11.3999 7.21995 12.7554 8.03754 4.80528 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 8.95571 11.806 9.24055 5.39888 8.02261 7.38126 numMergedOcc 0
6 mol 55 unq 1 iso 0 dist 8.95571 12.3757 9.66898 5.39888 8.02261 10.7639 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 8.6338 10.0633 8.8795 6.16737 8.44473 10.0338 numMergedOcc 0
8 mol 61 unq 1 iso 0 dist 7.31677 6.30737 8.8795 4.90701 8.44473 10.0338 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 9.82294 7.89444 5.66803 11.9545 9.15386 6.33529 numMergedOcc 0
10 mol 64 unq 1 iso 0 dist 9.82294 18.0124 8.85416 11.9545 9.15386 10.9729 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 8.73093 12.3943 7.48556 8.60018 6.4104 7.52996 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 9.1622 17.0484 8.07498 16.5419 9.04731 4.97477 numMergedOcc 0
13 mol 73 unq 2 iso 0 dist 9.1622 17.0484 8.07498 5.96946 9.85884 16.0506 numMergedOcc 0
14 mol 73 unq 3 iso 0 dist 9.1622 12.3943 9.47045 16.5419 9.04731 10.5755 numMergedOcc 0
15 mol 73 unq 4 iso 0 dist 9.1622 12.3943 9.47045 5.96946 9.85884 9.80866 numMergedOcc 0
16 mol 73 unq 5 iso 0 dist 8.02104 9.57143 7.48556 7.06343 6.4104 7.52996 numMergedOcc 0
17 mol 73 unq 6 iso 0 dist 7.59013 14.8028 8.07498 13.6614 9.04731 4.97477 numMergedOcc 0
18 mol 73 unq 7 iso 0 dist 7.59013 14.8028 8.07498 3.27963 9.85884 16.0506 numMergedOcc 0
19 mol 73 unq 8 iso 0 dist 7.59013 9.57143 9.47045 13.6614 9.04731 10.5755 numMergedOcc 0
20 mol 73 unq 9 iso 0 dist 7.59013 9.57143 9.47045 3.27963 9.85884 9.80866 numMergedOcc 0
21 mol 115 unq 0 iso 0 dist 5.73946 4.75292 9.33293 6.75472 7.9258 9.48465 numMergedOcc 0
22 mol 117 unq 0 iso 0 dist 7.82249 4.41948 7.79078 6.7814 9.32858 10.7092 numMergedOcc 0
23 mol 129 unq 0 iso 0 dist 5.16531 12.2874 9.52061 10.0961 8.59695 5.99695 numMergedOcc 0
24 mol 129 unq 1 iso 0 dist 6.65878 5.0466 7.6453 5.56946 8.00624 4.80675 numMergedOcc 0
25 mol 129 unq 2 iso 0 dist 6.65878 5.0466 7.6453 6.10584 8.42289 7.01358 numMergedOcc 0
26 mol 133 unq 0 iso 0 dist 9.56319 14.3149 8.8353 14.4095 9.47554 17.2988 numMergedOcc 0
27 mol 133 unq 1 iso 0 dist 9.73038 17.9749 8.8353 5.37072 9.47554 17.2988 numMergedOcc 0
28 mol 147 unq 0 iso 0 dist 5.47265 7.75436 5.32865 6.91778 9.88662 12.348 numMergedOcc 0
29 mol 152 unq 0 iso 0 dist 9.66811 7.14779 9.65031 13.3909 8.41774 14.069 numMergedOcc 0
30 mol 152 unq 1 iso 0 dist 9.66811 9.85198 8.51844 13.3909 8.41774 4.46956 numMergedOcc 0
31 mol 158 unq 0 iso 0 dist 8.80952 11.2678 9.96635 6.84127 9.99005 16.6371 numMergedOcc 0
32 mol 170 unq 0 iso 0 dist 9.05865 9.56212 8.10386 7.71028 9.32245 12.9081 numMergedOcc 0
33 mol 195 unq 0 iso 0 dist 9.35664 10.612 7.2833 8.95444 7.04524 5.34788 numMergedOcc 0
34 mol 233 unq 0 iso 0 dist 8.01777 12.4724 6.9103 6.52848 7.41931 10.2837 numMergedOcc 0
35 mol 236 unq 0 iso 0 dist 9.51001 11.094 4.71683 16.4752 9.44496 5.52669 numMergedOcc 0
36 mol 236 unq 1 iso 0 dist 9.51001 11.094 4.71683 4.15973 7.87233 7.77821 numMergedOcc 0
37 mol 239 unq 0 iso 0 dist 4.53228 10.9464 8.26312 8.37622 7.78671 7.05402 numMergedOcc 0
38 mol 239 unq 1 iso 0 dist 4.53228 6.54316 7.58554 8.37622 7.78671 8.27566 numMergedOcc 0
39 mol 239 unq 2 iso 0 dist 8.54078 10.4394 8.26312 5.55494 7.78671 7.05402 numMergedOcc 0
40 mol 239 unq 3 iso 0 dist 8.54078 6.2497 7.58554 5.55494 7.78671 8.27566 numMergedOcc 0
41 mol 265 unq 0 iso 0 dist 8.5774 7.53666 7.52632 4.39816 6.45326 6.35501 numMergedOcc 0
42 mol 265 unq 1 iso 0 dist 9.94957 4.47698 7.52632 10.4948 6.45326 6.35501 numMergedOcc 0
43 mol 265 unq 2 iso 0 dist 8.01664 5.62902 7.52632 7.73011 6.45326 6.35501 numMergedOcc 0
44 mol 271 unq 0 iso 0 dist 6.96986 12.846 9.50884 8.72109 9.42899 7.30308 numMergedOcc 0
45 mol 277 unq 0 iso 0 dist 8.99435 9.74634 8.04712 4.84657 6.03235 5.28949 numMergedOcc 0
