0 mol 1 unq 0 iso 0 dist 5.55208 8.93702 6.28655 7.48521 8.3673 5.96833 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.5933 8.93702 10.1521 7.48521 12.042 5.96833 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 7.46191 8.93702 10.2276 7.48521 12.7448 5.96833 numMergedOcc 0
3 mol 7 unq 0 iso 0 dist 9.25234 9.34656 11.5809 16.3136 18.8175 8.81608 numMergedOcc 0
4 mol 20 unq 0 iso 0 dist 7.67558 8.71628 12.111 5.06894 11.8839 5.9809 numMergedOcc 0
5 mol 20 unq 1 iso 0 dist 7.67558 8.71628 12.111 9.95303 15.8801 5.83917 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 9.00943 4.89196 7.29999 7.751 5.6359 9.1062 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 5.4104 6.12126 6.31583 5.61773 9.02144 6.47811 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 7.31892 4.87879 5.76685 8.17498 11.1317 5.73203 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 7.31892 4.87879 5.76685 10.9758 10.7457 6.57379 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.47392 9.55297 11.805 11.0797 15.2083 7.54341 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 6.45268 4.80429 5.06267 5.36933 8.38459 8.65196 numMergedOcc 0
12 mol 213 unq 1 iso 0 dist 6.45268 6.38872 4.91881 5.36933 8.38459 5.461 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 6.89242 6.31342 6.4725 4.94099 10.2112 5.93063 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 6.59321 7.99897 4.43794 9.1334 11.2143 8.24424 numMergedOcc 0
15 mol 233 unq 1 iso 0 dist 6.59321 7.99897 4.43794 9.81222 10.1504 7.0942 numMergedOcc 0
16 mol 233 unq 2 iso 0 dist 6.59321 7.99897 4.43794 5.17683 5.29501 6.01775 numMergedOcc 0
17 mol 233 unq 3 iso 0 dist 9.80759 7.99897 11.2489 9.1334 16.7991 8.24424 numMergedOcc 0
18 mol 233 unq 4 iso 0 dist 9.80759 7.99897 11.2489 9.81222 15.4586 7.0942 numMergedOcc 0
19 mol 233 unq 5 iso 0 dist 9.80759 7.99897 11.2489 5.17683 8.81206 6.01775 numMergedOcc 0
20 mol 233 unq 6 iso 0 dist 6.09111 8.98366 6.99665 12.3327 13.5679 8.24424 numMergedOcc 0
21 mol 233 unq 7 iso 0 dist 6.09111 8.98366 6.99665 8.89879 10.934 7.0942 numMergedOcc 0
22 mol 233 unq 8 iso 0 dist 6.09111 8.98366 6.99665 9.7363 7.86214 6.01775 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 7.5129 9.50619 8.29529 9.31424 8.52702 5.7791 numMergedOcc 0
24 mol 267 unq 0 iso 0 dist 9.54595 6.87713 10.8336 5.30771 8.63426 6.32877 numMergedOcc 0
25 mol 267 unq 1 iso 0 dist 9.54595 6.87713 10.8336 7.81198 14.5905 9.48115 numMergedOcc 0
26 mol 267 unq 2 iso 0 dist 9.54595 6.87713 10.8336 14.1912 18.6013 8.38545 numMergedOcc 0
27 mol 267 unq 3 iso 0 dist 9.54595 6.87713 10.8336 10.6273 14.5477 5.08174 numMergedOcc 0
28 mol 267 unq 4 iso 0 dist 9.54595 6.87713 10.8336 11.0675 16.7254 6.10838 numMergedOcc 0
29 mol 267 unq 5 iso 0 dist 9.04294 8.87518 7.37981 11.6034 8.04091 6.32877 numMergedOcc 0
30 mol 267 unq 6 iso 0 dist 9.04294 8.87518 7.37981 12.9552 13.2996 9.48115 numMergedOcc 0
31 mol 267 unq 7 iso 0 dist 9.04294 8.87518 7.37981 5.23612 12.2265 8.38545 numMergedOcc 0
32 mol 267 unq 8 iso 0 dist 9.04294 8.87518 7.37981 10.1261 10.6588 5.08174 numMergedOcc 0
33 mol 267 unq 9 iso 0 dist 9.04294 8.87518 7.37981 9.74815 12.5562 6.10838 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 7.19754 8.70062 8.6202 9.8719 14.5758 8.59762 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 7.19754 8.70062 8.6202 9.8719 14.5758 8.59762 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 7.19754 8.70062 8.6202 9.8719 14.5758 8.59762 numMergedOcc 0
