0 mol 7 unq 0 iso 0 dist 8.33249 5.47645 5.77374 11.7898 6.0323 9.30196 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.34604 5.47645 8.57437 9.225 8.85869 13.63 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.43675 13.394 8.57437 3.87123 8.85869 13.63 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 8.78474 3.89419 8.55031 10.1207 8.16059 11.9729 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 8.24314 10.1729 8.55031 6.02415 8.16059 11.9729 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 6.5121 4.65487 9.14092 7.3032 7.19254 6.66049 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 8.88571 5.15272 9.82315 8.75125 6.85094 5.78708 numMergedOcc 0
7 mol 61 unq 1 iso 0 dist 8.92623 12.7474 9.67403 12.3781 9.94756 16.6923 numMergedOcc 0
8 mol 61 unq 2 iso 0 dist 8.92623 10.4703 7.28917 12.3781 9.94756 4.16192 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.54374 17.5231 9.78545 9.06972 6.95094 14.5223 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 8.54374 15.2861 9.97998 9.06972 6.95094 11.7502 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 7.76963 6.03473 9.06225 11.9775 7.71596 13.42 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 8.64606 10.581 5.82034 7.83675 4.95086 6.97601 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 8.64606 10.581 5.82034 14.9083 8.39524 4.59451 numMergedOcc 0
14 mol 147 unq 2 iso 0 dist 8.64606 11.7424 6.56854 7.83675 4.95086 5.23184 numMergedOcc 0
15 mol 147 unq 3 iso 0 dist 8.64606 11.7424 6.56854 14.9083 8.39524 4.8897 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 9.4113 4.62506 9.53814 7.15977 5.34451 6.07309 numMergedOcc 0
17 mol 180 unq 0 iso 0 dist 8.00985 4.73248 8.24157 8.47463 6.83301 5.76764 numMergedOcc 0
18 mol 183 unq 0 iso 0 dist 9.84306 9.24396 9.92635 19.3099 9.81282 15.7519 numMergedOcc 0
19 mol 183 unq 1 iso 0 dist 9.84306 6.29417 7.85507 19.3099 9.81282 15.2905 numMergedOcc 0
20 mol 185 unq 0 iso 0 dist 8.93886 4.85027 5.40655 10.3636 6.11382 8.51 numMergedOcc 0
21 mol 199 unq 0 iso 0 dist 6.33787 4.91787 7.16849 5.47687 7.29716 4.98653 numMergedOcc 0
22 mol 211 unq 0 iso 0 dist 7.79873 6.83095 7.38723 5.6174 7.15386 5.45968 numMergedOcc 0
23 mol 211 unq 1 iso 0 dist 7.79873 6.83095 7.38723 4.00712 7.73993 9.04294 numMergedOcc 0
24 mol 211 unq 2 iso 0 dist 7.79873 6.83095 7.38723 10.088 9.45365 9.3095 numMergedOcc 0
25 mol 226 unq 0 iso 0 dist 7.28604 12.9282 8.10096 9.41453 9.05082 12.8829 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 8.23266 6.26153 6.11539 9.46908 7.33708 5.99119 numMergedOcc 0
27 mol 232 unq 1 iso 0 dist 8.23266 6.26153 6.11539 7.81196 4.46314 5.10642 numMergedOcc 0
28 mol 232 unq 2 iso 0 dist 8.23266 8.73691 9.71082 9.46908 7.33708 14.9027 numMergedOcc 0
29 mol 232 unq 3 iso 0 dist 8.23266 8.73691 9.71082 7.81196 4.46314 6.19573 numMergedOcc 0
30 mol 250 unq 0 iso 0 dist 9.61711 5.34692 8.62074 7.46413 9.08048 11.1655 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 8.10271 10.604 9.33447 5.68798 6.35457 9.20929 numMergedOcc 0
32 mol 266 unq 1 iso 0 dist 8.10271 5.75486 3.90274 5.68798 6.35457 4.55986 numMergedOcc 0
33 mol 266 unq 2 iso 0 dist 6.1277 5.75486 7.49024 5.83215 9.27042 8.79928 numMergedOcc 0
