0 mol 7 unq 0 iso 0 dist 6.0323 7.15434 5.70161 9.89662 5.27578 10.6926 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 5.16345 8.21595 5.59189 6.10997 7.24295 12.4936 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 5.16345 9.60744 7.78507 6.10997 7.24295 13.1016 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.10175 6.54183 10.1356 5.01159 5.7405 10.4158 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 9.49909 8.40931 7.40093 6.93938 8.81003 12.6304 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.99156 6.10011 10.4402 10.38 9.53327 16.3471 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.99156 8.124 8.0624 10.38 9.53327 16.1385 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 4.85152 5.90776 6.82886 5.47738 7.2131 5.37007 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 4.85152 5.90776 6.82886 4.665 7.44343 9.71168 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 8.87856 5.85841 6.83826 4.81103 4.94406 5.78706 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 8.87856 7.00285 9.94628 4.81103 4.94406 5.59328 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 6.2491 5.85841 9.30656 4.81103 7.2337 5.78706 numMergedOcc 0
12 mol 98 unq 3 iso 0 dist 6.2491 7.00285 5.39087 4.81103 7.2337 5.59328 numMergedOcc 0
13 mol 98 unq 4 iso 0 dist 3.59451 6.78839 9.30656 7.22196 7.2337 5.78706 numMergedOcc 0
14 mol 98 unq 5 iso 0 dist 3.59451 8.02354 5.39087 7.22196 7.2337 5.59328 numMergedOcc 0
15 mol 124 unq 0 iso 0 dist 5.61764 6.35314 5.31501 4.26006 8.18186 9.79969 numMergedOcc 0
16 mol 125 unq 0 iso 0 dist 6.6081 7.76202 6.92879 7.74181 9.2657 7.47069 numMergedOcc 0
17 mol 125 unq 1 iso 0 dist 9.64304 6.03557 9.19339 8.27647 9.2657 9.3778 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 7.8034 9.33945 8.25445 11.5898 9.39811 11.832 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 8.51265 7.34465 13.1327 13.1683 7.35385 16.5386 numMergedOcc 0
20 mol 141 unq 1 iso 0 dist 8.51265 7.34465 13.1327 9.00056 8.35864 11.0743 numMergedOcc 0
21 mol 141 unq 2 iso 0 dist 8.51265 9.47675 10.4653 13.1683 7.35385 13.5519 numMergedOcc 0
22 mol 141 unq 3 iso 0 dist 8.51265 9.47675 10.4653 9.00056 8.35864 9.97343 numMergedOcc 0
23 mol 141 unq 4 iso 0 dist 9.98097 7.97349 7.20524 10.537 9.80549 14.5189 numMergedOcc 0
24 mol 156 unq 0 iso 0 dist 6.67598 9.19499 5.0966 5.02458 9.6281 9.44367 numMergedOcc 0
25 mol 156 unq 1 iso 0 dist 6.67598 7.11647 5.75141 5.02458 9.6281 7.90267 numMergedOcc 0
26 mol 156 unq 2 iso 0 dist 8.79185 9.19499 9.07974 5.02458 6.22667 9.44367 numMergedOcc 0
27 mol 156 unq 3 iso 0 dist 8.79185 7.11647 5.70205 5.02458 6.22667 7.90267 numMergedOcc 0
28 mol 219 unq 0 iso 0 dist 7.98941 6.8424 10.9246 14.1483 9.30312 16.5657 numMergedOcc 0
29 mol 224 unq 0 iso 0 dist 6.36813 9.74059 13.311 8.0412 8.81349 13.8083 numMergedOcc 0
30 mol 224 unq 1 iso 0 dist 8.68767 9.73411 14.3302 5.77278 9.42667 14.5387 numMergedOcc 0
31 mol 224 unq 2 iso 0 dist 8.68767 7.75485 9.74911 5.77278 9.42667 12.8311 numMergedOcc 0
32 mol 253 unq 0 iso 0 dist 9.35766 7.26981 9.56248 10.5693 9.6479 10.6345 numMergedOcc 0
33 mol 256 unq 0 iso 0 dist 8.11884 5.98967 9.07441 12.3321 7.40057 13.0251 numMergedOcc 0
34 mol 274 unq 0 iso 0 dist 8.17922 5.82876 7.97998 4.48276 8.30714 7.46394 numMergedOcc 0
35 mol 274 unq 1 iso 0 dist 8.17922 8.71129 5.7745 4.48276 8.30714 7.1729 numMergedOcc 0
36 mol 277 unq 0 iso 0 dist 9.42812 7.07459 13.8339 13.008 5.92532 17.3351 numMergedOcc 0
37 mol 279 unq 0 iso 0 dist 8.76889 5.70546 9.36068 4.99186 8.16582 7.23721 numMergedOcc 0
