0 mol 16 unq 0 iso 0 dist 9.76968 12.1754 7.63133 13.1436 5.66097 7.46752 13.862 5.32694 5.46498 6.06561 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.76968 12.1754 7.63133 13.1436 5.66097 7.46752 19.1237 10.4155 8.71745 8.02077 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 7.7978 6.8958 7.17396 10.9901 8.94845 6.46655 10.3954 6.05545 9.21998 6.32263 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 9.55751 5.85228 7.17396 9.41952 8.94845 6.46655 10.7234 6.05545 9.21998 6.32263 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.58793 7.83419 7.66905 7.61312 3.85308 9.22376 10.7244 5.42586 7.47541 5.75796 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 6.58793 7.83419 7.66905 7.61312 3.85308 9.22376 11.7434 10.1164 5.73196 9.77828 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 9.72689 13.7794 9.36773 20.5555 13.1838 7.76275 11.4004 5.57085 8.31336 12.6939 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 7.74197 4.0486 9.36773 5.74637 13.1838 7.76275 7.86537 5.57085 8.31336 12.6939 numMergedOcc 0
8 mol 88 unq 2 iso 0 dist 7.86537 4.0486 8.31336 5.74637 12.6939 7.76275 7.74197 5.57085 9.36773 13.1838 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 9.65047 5.69671 8.03644 10.6171 15.4217 8.26838 12.5791 16.6055 9.03572 4.33346 numMergedOcc 0
10 mol 95 unq 1 iso 0 dist 9.65047 5.69671 8.03644 10.6171 15.4217 8.26838 13.9545 13.8105 8.83255 7.47119 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 5.02717 11.0268 7.88312 10.2401 7.64822 9.56867 12.5189 7.69052 6.11741 9.97256 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 7.85877 4.82768 7.21333 11.4498 9.97859 8.69148 10.8522 13.3522 8.01589 6.52189 numMergedOcc 0
13 mol 222 unq 1 iso 0 dist 7.85877 4.82768 7.21333 11.4498 9.97859 8.69148 10.0664 5.24516 7.7699 5.33282 numMergedOcc 0
14 mol 231 unq 0 iso 0 dist 8.01942 8.55683 8.40182 14.4754 10.2117 9.98232 9.97221 4.06055 7.37839 10.9863 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 9.89665 4.38595 6.84306 13.6852 4.88785 9.97357 11.3361 5.79505 8.03456 8.3919 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 9.89665 4.38595 6.84306 13.6852 4.88785 9.97357 14.0991 11.3368 9.99038 10.2557 numMergedOcc 0
17 mol 236 unq 2 iso 0 dist 9.89665 4.38595 6.84306 13.6852 4.88785 9.97357 11.8422 11.8739 9.78037 14.6755 numMergedOcc 0
18 mol 236 unq 3 iso 0 dist 9.89665 4.38595 6.84306 13.6852 4.88785 9.97357 9.05929 14.7998 8.35971 16.5918 numMergedOcc 0
19 mol 236 unq 4 iso 0 dist 9.89665 11.247 7.68742 13.6852 4.88785 6.36941 11.3361 5.79505 9.81562 8.3919 numMergedOcc 0
20 mol 236 unq 5 iso 0 dist 9.89665 11.247 7.68742 13.6852 4.88785 6.36941 14.0991 11.3368 6.27581 10.2557 numMergedOcc 0
21 mol 236 unq 6 iso 0 dist 9.05929 4.38595 8.35971 13.6852 16.5918 9.97357 11.3361 14.2337 8.03456 8.3919 numMergedOcc 0
22 mol 236 unq 7 iso 0 dist 9.05929 4.38595 8.35971 13.6852 16.5918 9.97357 9.89665 14.7998 6.84306 4.88785 numMergedOcc 0
23 mol 236 unq 8 iso 0 dist 9.05929 4.38595 8.35971 13.6852 16.5918 9.97357 14.0991 10.7497 9.99038 10.2557 numMergedOcc 0
24 mol 236 unq 9 iso 0 dist 9.05929 4.38595 8.35971 13.6852 16.5918 9.97357 11.8422 12.0369 9.78037 14.6755 numMergedOcc 0
25 mol 236 unq 10 iso 0 dist 8.90987 16.8883 8.35971 13.6603 5.27568 6.73134 15.2598 7.43758 8.04248 5.52669 numMergedOcc 0
26 mol 236 unq 11 iso 0 dist 5.66569 11.2013 9.99038 8.20542 10.2557 9.97357 12.3675 9.90963 8.03456 8.3919 numMergedOcc 0
27 mol 236 unq 12 iso 0 dist 5.66569 11.2013 9.99038 8.20542 10.2557 9.97357 11.0771 11.3368 6.84306 4.88785 numMergedOcc 0
28 mol 236 unq 13 iso 0 dist 5.66569 11.2013 9.99038 8.20542 10.2557 9.97357 15.7385 11.1557 9.78037 14.6755 numMergedOcc 0
29 mol 236 unq 14 iso 0 dist 5.66569 11.2013 9.99038 8.20542 10.2557 9.97357 13.3367 10.7497 8.35971 16.5918 numMergedOcc 0
30 mol 236 unq 15 iso 0 dist 5.66569 4.15973 6.27581 8.20542 10.2557 6.36941 12.3675 9.90963 9.81562 8.3919 numMergedOcc 0
31 mol 236 unq 16 iso 0 dist 5.66569 4.15973 6.27581 8.20542 10.2557 6.36941 11.0771 11.3368 7.68742 4.88785 numMergedOcc 0
32 mol 236 unq 17 iso 0 dist 6.11137 15.1664 9.99038 12.2537 10.2557 9.97357 14.8917 9.90963 8.03456 8.3919 numMergedOcc 0
33 mol 236 unq 18 iso 0 dist 6.11137 15.1664 9.99038 12.2537 10.2557 9.97357 15.2525 11.3368 6.84306 4.88785 numMergedOcc 0
34 mol 236 unq 19 iso 0 dist 6.11137 15.1664 9.99038 12.2537 10.2557 9.97357 17.0539 11.1557 9.78037 14.6755 numMergedOcc 0
35 mol 236 unq 20 iso 0 dist 6.11137 15.1664 9.99038 12.2537 10.2557 9.97357 15.4718 10.7497 8.35971 16.5918 numMergedOcc 0
36 mol 236 unq 21 iso 0 dist 6.11137 9.01197 6.27581 12.2537 10.2557 6.36941 14.8917 9.90963 9.81562 8.3919 numMergedOcc 0
37 mol 236 unq 22 iso 0 dist 6.11137 9.01197 6.27581 12.2537 10.2557 6.36941 15.2525 11.3368 7.68742 4.88785 numMergedOcc 0
38 mol 253 unq 0 iso 0 dist 8.91612 5.11865 6.73034 12.3062 6.27022 7.71295 12.868 8.02948 8.31064 4.84708 numMergedOcc 0
39 mol 259 unq 0 iso 0 dist 5.90645 10.4985 8.13497 12.4319 10.908 6.96379 9.73107 4.69778 7.88519 12.7595 numMergedOcc 0
