0 mol 9 unq 0 iso 0 dist 9.99657 6.53202 8.48677 11.6529 6.17866 6.55811 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.99657 6.53202 8.48677 10.738 4.41171 7.36018 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 9.78754 5.71129 6.35398 9.84802 7.0964 4.30695 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 7.05148 5.59268 7.92503 11.6272 12.7398 6.16347 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 9.55838 9.96691 6.36086 13.6495 6.00618 7.26024 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 5.51406 10.2967 9.30539 10.8615 9.17687 9.01176 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 5.93987 4.73713 8.18107 7.7913 9.38827 5.9465 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 5.93987 4.36394 9.8859 7.7913 9.38827 6.97962 numMergedOcc 0
8 mol 92 unq 2 iso 0 dist 7.7913 4.73713 5.9465 5.93987 9.38827 8.18107 numMergedOcc 0
9 mol 92 unq 3 iso 0 dist 7.7913 4.36394 6.97962 5.93987 9.38827 9.8859 numMergedOcc 0
10 mol 92 unq 4 iso 0 dist 9.18898 4.52119 6.95572 7.67331 6.36037 7.38677 numMergedOcc 0
11 mol 92 unq 5 iso 0 dist 7.67331 4.52119 7.38677 9.18898 6.36037 6.95572 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.48774 11.1132 6.60933 14.7325 10.6137 7.02927 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 9.53055 6.78736 6.60933 13.7295 10.6137 7.02927 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 5.37302 14.0364 9.66219 9.09263 4.09459 8.8822 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 9.66068 16.3524 8.8822 8.03783 4.09459 9.66219 numMergedOcc 0
16 mol 113 unq 2 iso 0 dist 8.03783 16.3524 9.66219 9.66068 4.09459 8.8822 numMergedOcc 0
17 mol 113 unq 3 iso 0 dist 8.47541 12.1308 9.66219 10.1107 4.09459 8.8822 numMergedOcc 0
18 mol 129 unq 0 iso 0 dist 9.86988 7.59962 7.58957 13.3186 7.91034 6.28565 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 6.16862 12.7925 9.22232 21.9366 18.2432 9.22661 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 6.16862 12.7925 9.22232 18.0076 15.4484 7.56378 numMergedOcc 0
21 mol 133 unq 2 iso 0 dist 9.70325 15.4258 9.22232 24.2774 18.2432 9.22661 numMergedOcc 0
22 mol 133 unq 3 iso 0 dist 9.70325 15.4258 9.22232 19.5801 15.4484 7.56378 numMergedOcc 0
23 mol 133 unq 4 iso 0 dist 6.42904 6.26797 9.22661 14.2733 18.2432 9.22232 numMergedOcc 0
24 mol 133 unq 5 iso 0 dist 6.42904 6.26797 9.22661 10.0298 7.33253 7.56378 numMergedOcc 0
25 mol 133 unq 6 iso 0 dist 7.31633 5.36939 7.56378 9.21481 15.4484 9.22232 numMergedOcc 0
26 mol 133 unq 7 iso 0 dist 7.31633 5.36939 7.56378 11.4454 7.33253 9.22661 numMergedOcc 0
27 mol 135 unq 0 iso 0 dist 5.43728 8.13139 5.62052 9.71735 6.35752 7.90563 numMergedOcc 0
28 mol 135 unq 1 iso 0 dist 5.43728 5.88534 7.85645 9.71735 6.35752 8.97655 numMergedOcc 0
29 mol 148 unq 0 iso 0 dist 9.80819 9.27313 6.22055 11.0479 4.32771 9.91993 numMergedOcc 0
30 mol 148 unq 1 iso 0 dist 9.80819 12.8573 8.18085 11.0479 4.32771 9.99156 numMergedOcc 0
31 mol 150 unq 0 iso 0 dist 9.81665 9.25213 6.14675 11.1963 4.39943 9.96691 numMergedOcc 0
32 mol 150 unq 1 iso 0 dist 9.81665 9.25213 6.14675 13.8927 4.30207 9.24244 numMergedOcc 0
33 mol 150 unq 2 iso 0 dist 9.81665 12.8265 7.94889 11.1963 4.39943 9.8656 numMergedOcc 0
34 mol 150 unq 3 iso 0 dist 9.33412 6.48118 9.24244 11.4553 5.93611 9.96691 numMergedOcc 0
35 mol 150 unq 4 iso 0 dist 9.33412 6.48118 9.24244 8.60817 4.30207 6.14675 numMergedOcc 0
36 mol 170 unq 0 iso 0 dist 9.53158 7.71028 6.35982 12.7875 6.24983 7.51126 numMergedOcc 0
37 mol 181 unq 0 iso 0 dist 6.95568 4.11061 6.59025 10.5689 9.87773 6.46704 numMergedOcc 0
38 mol 181 unq 1 iso 0 dist 9.07527 9.32503 5.9176 14.9148 9.53592 6.41453 numMergedOcc 0
39 mol 188 unq 0 iso 0 dist 9.37017 4.04545 8.10214 10.8092 9.01338 7.14503 numMergedOcc 0
40 mol 195 unq 0 iso 0 dist 8.80931 5.90604 7.36683 12.6532 9.90317 6.95086 numMergedOcc 0
41 mol 197 unq 0 iso 0 dist 7.40027 5.29309 6.92924 11.2331 9.20574 7.50013 numMergedOcc 0
42 mol 197 unq 1 iso 0 dist 7.40027 5.29309 6.92924 10.433 11.2132 5.81233 numMergedOcc 0
43 mol 197 unq 2 iso 0 dist 7.40027 5.29309 6.92924 11.0908 8.81358 7.14306 numMergedOcc 0
44 mol 197 unq 3 iso 0 dist 8.98598 4.57437 7.50013 7.06689 5.33623 5.81233 numMergedOcc 0
45 mol 197 unq 4 iso 0 dist 8.98598 4.57437 7.50013 9.69601 9.20574 6.92924 numMergedOcc 0
46 mol 197 unq 5 iso 0 dist 8.98598 4.57437 7.50013 11.6502 10.8407 7.14306 numMergedOcc 0
47 mol 197 unq 6 iso 0 dist 7.06689 4.57437 5.81233 8.98598 5.33623 7.50013 numMergedOcc 0
48 mol 197 unq 7 iso 0 dist 7.06689 4.57437 5.81233 9.69601 11.2132 6.92924 numMergedOcc 0
49 mol 197 unq 8 iso 0 dist 7.06689 4.57437 5.81233 11.6502 9.56047 7.14306 numMergedOcc 0
50 mol 197 unq 9 iso 0 dist 9.69601 4.57437 6.92924 8.98598 9.20574 7.50013 numMergedOcc 0
51 mol 197 unq 10 iso 0 dist 9.69601 4.57437 6.92924 7.06689 11.2132 5.81233 numMergedOcc 0
52 mol 197 unq 11 iso 0 dist 9.69601 4.57437 6.92924 11.6502 8.81358 7.14306 numMergedOcc 0
53 mol 222 unq 0 iso 0 dist 5.89818 4.82768 7.67576 9.32543 11.3283 9.82371 numMergedOcc 0
54 mol 222 unq 1 iso 0 dist 9.32543 4.82768 9.82371 5.89818 11.3283 7.67576 numMergedOcc 0
55 mol 237 unq 0 iso 0 dist 8.42502 10.0582 9.20822 12.5878 8.65228 7.41478 numMergedOcc 0
