0 mol 7 unq 0 iso 0 dist 8.72114 9.67164 5.5683 10.515 9.97624 8.81608 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.99972 5.99459 6.12483 6.06176 10.6471 8.81608 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 6.42748 8.85174 5.20798 6.67334 6.50647 9.51568 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 6.16347 9.48085 9.62058 12.1492 10.7875 8.53931 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 7.45383 9.49421 9.62058 4.70708 10.7875 8.53931 numMergedOcc 0
5 mol 25 unq 2 iso 0 dist 9.01548 9.49421 5.38592 4.70708 6.63839 8.53931 numMergedOcc 0
6 mol 25 unq 3 iso 0 dist 7.92503 9.48085 10.2758 12.1492 16.6259 8.53931 numMergedOcc 0
7 mol 32 unq 0 iso 0 dist 7.99969 7.26268 6.30042 6.68431 4.62858 8.74576 numMergedOcc 0
8 mol 62 unq 0 iso 0 dist 7.56205 9.69044 4.09232 11.7069 6.04903 9.1062 numMergedOcc 0
9 mol 62 unq 1 iso 0 dist 4.74544 6.9103 4.09232 5.49555 6.04903 9.1062 numMergedOcc 0
10 mol 72 unq 0 iso 0 dist 9.27838 7.12321 14.005 9.0131 13.1462 9.14817 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 6.7117 5.10496 3.94967 8.70415 6.0129 6.61111 numMergedOcc 0
12 mol 98 unq 1 iso 0 dist 7.23884 9.64383 12.82 12.0058 15.3281 4.44979 numMergedOcc 0
13 mol 98 unq 2 iso 0 dist 4.47349 7.54889 3.92737 10.0962 6.0129 4.44979 numMergedOcc 0
14 mol 98 unq 3 iso 0 dist 4.47349 5.2571 3.94967 10.0962 6.0129 6.61111 numMergedOcc 0
15 mol 98 unq 4 iso 0 dist 5.65185 7.78931 3.92737 11.2452 6.0129 4.44979 numMergedOcc 0
16 mol 98 unq 5 iso 0 dist 5.65185 8.7497 3.94967 11.2452 6.0129 6.61111 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 9.11344 6.99446 5.37917 6.35763 11.1099 6.13374 numMergedOcc 0
18 mol 119 unq 1 iso 0 dist 9.11344 6.99446 5.37917 7.36192 11.8717 9.08536 numMergedOcc 0
19 mol 119 unq 2 iso 0 dist 6.52773 7.64052 5.37917 10.0197 11.1099 6.13374 numMergedOcc 0
20 mol 119 unq 3 iso 0 dist 6.52773 7.64052 5.37917 10.6679 11.8717 9.08536 numMergedOcc 0
21 mol 119 unq 4 iso 0 dist 8.00003 8.95212 12.3661 10.3457 16.109 6.13374 numMergedOcc 0
22 mol 119 unq 5 iso 0 dist 8.00003 8.95212 12.3661 16.7975 19.5351 9.08536 numMergedOcc 0
23 mol 119 unq 6 iso 0 dist 9.23858 7.64052 15.7711 10.0197 18.7646 6.13374 numMergedOcc 0
24 mol 119 unq 7 iso 0 dist 9.23858 7.64052 15.7711 10.6679 15.8603 9.08536 numMergedOcc 0
25 mol 134 unq 0 iso 0 dist 6.23142 9.33094 6.93712 5.3585 8.55616 7.43401 numMergedOcc 0
26 mol 134 unq 1 iso 0 dist 9.94764 9.1998 11.5269 6.74887 8.55616 6.44575 numMergedOcc 0
27 mol 134 unq 2 iso 0 dist 9.94764 8.69531 6.93712 6.74887 8.55616 7.43401 numMergedOcc 0
28 mol 143 unq 0 iso 0 dist 7.78652 7.36975 12.207 6.01455 6.46089 7.05845 numMergedOcc 0
29 mol 143 unq 1 iso 0 dist 7.78652 7.36975 12.207 5.44503 13.204 8.18023 numMergedOcc 0
30 mol 143 unq 2 iso 0 dist 7.78652 5.40637 10.0079 5.44503 13.204 7.46803 numMergedOcc 0
31 mol 143 unq 3 iso 0 dist 8.91301 7.36975 14.7271 6.01455 10.1154 7.05845 numMergedOcc 0
32 mol 143 unq 4 iso 0 dist 8.91301 7.36975 14.7271 5.44503 13.8861 8.18023 numMergedOcc 0
33 mol 143 unq 5 iso 0 dist 8.91301 5.40637 9.05366 5.44503 13.8861 7.46803 numMergedOcc 0
34 mol 167 unq 0 iso 0 dist 9.67741 7.20495 5.43662 6.36909 7.80054 9.1326 numMergedOcc 0
35 mol 167 unq 1 iso 0 dist 9.67741 7.02548 5.95858 6.36909 7.80054 7.30954 numMergedOcc 0
36 mol 168 unq 0 iso 0 dist 7.44629 6.02086 4.02702 8.67522 7.60254 7.06851 numMergedOcc 0
37 mol 181 unq 0 iso 0 dist 5.94469 6.64173 4.98436 6.7991 7.05653 9.09234 numMergedOcc 0
38 mol 181 unq 1 iso 0 dist 5.94469 9.01624 11.9796 6.7991 7.05653 6.76746 numMergedOcc 0
39 mol 181 unq 2 iso 0 dist 5.94469 9.55105 12.3589 6.7991 7.05653 8.92098 numMergedOcc 0
40 mol 219 unq 0 iso 0 dist 7.59632 4.33238 5.75906 4.74167 11.4406 7.30481 numMergedOcc 0
41 mol 238 unq 0 iso 0 dist 9.24557 9.72188 17.1065 15.5674 18.5467 9.84652 numMergedOcc 0
42 mol 238 unq 1 iso 0 dist 7.10685 9.07475 5.37176 10.0613 12.5578 9.82327 numMergedOcc 0
43 mol 238 unq 2 iso 0 dist 7.10685 6.99888 6.65214 5.54325 10.1326 5.43613 numMergedOcc 0
44 mol 238 unq 3 iso 0 dist 7.10685 6.99888 6.65214 10.0613 12.5578 7.06768 numMergedOcc 0
45 mol 259 unq 0 iso 0 dist 7.08526 5.85442 4.47425 5.79468 8.71497 6.23661 numMergedOcc 0
46 mol 287 unq 0 iso 0 dist 9.65934 7.45616 5.97664 7.23534 5.59555 8.59762 numMergedOcc 0
47 mol 288 unq 0 iso 0 dist 9.65934 7.45616 5.97664 7.23534 5.59555 8.59762 numMergedOcc 0
48 mol 289 unq 0 iso 0 dist 9.65934 7.45616 5.97664 7.23534 5.59555 8.59762 numMergedOcc 0
49 mol 292 unq 0 iso 0 dist 7.83341 9.9182 13.4805 9.98079 17.2669 9.08193 numMergedOcc 0
50 mol 292 unq 1 iso 0 dist 7.83341 9.9182 13.4805 18.0293 21.7057 8.73515 numMergedOcc 0
51 mol 292 unq 2 iso 0 dist 9.88863 9.74118 3.92782 5.98906 5.7131 6.1905 numMergedOcc 0
52 mol 292 unq 3 iso 0 dist 8.87028 9.46442 6.00981 12.1551 11.7643 5.84792 numMergedOcc 0
53 mol 292 unq 4 iso 0 dist 8.87028 7.30758 4.09485 5.07048 11.9174 9.08193 numMergedOcc 0
54 mol 292 unq 5 iso 0 dist 8.87028 7.30758 4.09485 12.1551 11.7643 8.73515 numMergedOcc 0
