0 mol 19 unq 0 iso 0 dist 8.82056 4.07239 6.00439 10.1092 7.83352 6.20943 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.82056 4.07239 6.00439 10.0681 10.8007 7.82528 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 6.04163 11.4785 5.64598 10.7814 7.4697 8.70133 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 6.04163 11.4785 5.64598 10.3372 5.7113 4.65521 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.88953 12.0993 5.64598 16.2272 7.4697 8.70133 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.88953 12.0993 5.64598 13.6652 5.7113 4.65521 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 8.96262 4.79472 6.33365 8.64872 9.02771 5.15851 numMergedOcc 0
7 mol 75 unq 1 iso 0 dist 8.64872 4.79472 5.15851 8.96262 9.02771 6.33365 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 7.63534 6.55474 8.19682 9.58389 10.2879 6.21982 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 8.51543 8.36307 6.21982 15.1609 10.2879 8.19682 numMergedOcc 0
10 mol 90 unq 0 iso 0 dist 4.75701 8.43244 8.39016 10.9904 7.60026 6.99355 numMergedOcc 0
11 mol 90 unq 1 iso 0 dist 9.89618 12.4268 8.39016 14.4855 7.60026 6.99355 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 5.22628 9.16391 9.66954 11.2519 7.69052 8.66155 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 8.09965 9.46933 8.59981 15.0862 11.279 6.192 numMergedOcc 0
14 mol 127 unq 1 iso 0 dist 8.09965 9.46933 8.59981 15.8457 11.4958 7.69308 numMergedOcc 0
15 mol 127 unq 2 iso 0 dist 8.09965 9.46933 8.59981 10.0545 5.55757 7.66331 numMergedOcc 0
16 mol 127 unq 3 iso 0 dist 8.09965 6.50291 7.34519 10.0545 5.55757 8.58999 numMergedOcc 0
17 mol 127 unq 4 iso 0 dist 8.09965 6.50291 7.34519 10.9303 6.16471 6.63981 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 8.75736 9.88404 8.94837 6.32178 7.93571 7.77454 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 6.76166 6.15672 8.94837 7.2977 7.93571 7.77454 numMergedOcc 0
20 mol 134 unq 2 iso 0 dist 6.32178 9.88404 7.77454 8.75736 7.93571 8.94837 numMergedOcc 0
21 mol 134 unq 3 iso 0 dist 7.2977 6.15672 7.77454 6.76166 7.93571 8.94837 numMergedOcc 0
22 mol 173 unq 0 iso 0 dist 9.09857 9.00192 8.31897 10.6341 5.16343 7.93331 numMergedOcc 0
23 mol 173 unq 1 iso 0 dist 9.09857 9.00192 8.31897 13.4919 8.17887 6.98095 numMergedOcc 0
24 mol 183 unq 0 iso 0 dist 9.09322 6.93732 7.01383 11.7243 6.64382 9.93083 numMergedOcc 0
25 mol 183 unq 1 iso 0 dist 9.60723 4.50779 7.01383 11.5806 6.64382 9.93083 numMergedOcc 0
26 mol 213 unq 0 iso 0 dist 7.22234 15.6607 9.59129 20.3443 13.7995 8.45368 numMergedOcc 0
27 mol 213 unq 1 iso 0 dist 5.86501 10.1617 9.59129 16.4324 13.7995 8.45368 numMergedOcc 0
28 mol 224 unq 0 iso 0 dist 9.61379 5.98813 6.67585 11.7326 4.70378 6.65984 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 6.15754 4.48571 6.25105 8.9413 5.88703 7.85175 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 6.6281 5.91466 6.25105 11.5469 5.88703 7.85175 numMergedOcc 0
31 mol 234 unq 2 iso 0 dist 8.9413 4.48571 7.85175 6.15754 5.88703 6.25105 numMergedOcc 0
32 mol 234 unq 3 iso 0 dist 4.91961 11.1927 7.85175 10.2233 5.88703 6.25105 numMergedOcc 0
33 mol 235 unq 0 iso 0 dist 8.84872 13.4086 9.58736 16.1148 9.85037 9.43058 numMergedOcc 0
34 mol 235 unq 1 iso 0 dist 8.84872 13.4086 9.58736 19.4613 13.6669 8.75735 numMergedOcc 0
35 mol 235 unq 2 iso 0 dist 8.84872 13.4086 9.58736 18.3269 16.4493 6.98084 numMergedOcc 0
36 mol 235 unq 3 iso 0 dist 8.84872 13.4086 9.58736 19.9164 15.4 7.32211 numMergedOcc 0
37 mol 235 unq 4 iso 0 dist 8.79626 12.9417 7.32211 20.4877 15.4 9.58736 numMergedOcc 0
38 mol 235 unq 5 iso 0 dist 8.79626 12.9417 7.32211 21.9913 14.4107 9.43058 numMergedOcc 0
39 mol 235 unq 6 iso 0 dist 8.79626 12.9417 7.32211 19.3954 11.3789 8.75735 numMergedOcc 0
40 mol 235 unq 7 iso 0 dist 8.79626 12.9417 7.32211 10.0531 7.218 6.98084 numMergedOcc 0
41 mol 236 unq 0 iso 0 dist 5.99137 4.47231 5.34718 11.0371 7.28249 7.17676 numMergedOcc 0
42 mol 238 unq 0 iso 0 dist 6.51823 9.28896 6.77463 10.5699 5.31152 8.14172 numMergedOcc 0
43 mol 238 unq 1 iso 0 dist 6.51823 6.04481 7.2766 10.9573 8.87326 6.05141 numMergedOcc 0
44 mol 238 unq 2 iso 0 dist 6.51823 6.04481 7.2766 10.5699 5.31152 8.09066 numMergedOcc 0
45 mol 240 unq 0 iso 0 dist 7.0935 6.65921 6.15305 7.12912 4.28414 7.03489 numMergedOcc 0
46 mol 240 unq 1 iso 0 dist 7.12912 6.65921 7.03489 7.0935 4.28414 6.15305 numMergedOcc 0
47 mol 259 unq 0 iso 0 dist 6.20344 12.9748 7.48005 17.2632 12.5353 8.37865 numMergedOcc 0
48 mol 282 unq 0 iso 0 dist 7.12228 7.00729 7.32347 10.5849 5.39891 6.85028 numMergedOcc 0
49 mol 282 unq 1 iso 0 dist 7.12228 7.00729 7.32347 14.3073 10.5372 8.3411 numMergedOcc 0
