0 mol 20 unq 0 iso 0 dist 6.18007 3.89371 7.6974 6.54413 9.84488 7.69558 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.7649 8.97755 8.6586 14.2346 7.18124 9.42167 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.7649 8.97755 8.6586 6.7213 8.10168 9.53267 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.5268 7.14863 8.6586 11.9263 7.18124 9.42167 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.5268 7.14863 8.6586 3.83179 8.10168 9.53267 numMergedOcc 0
5 mol 28 unq 0 iso 0 dist 9.56722 12.1174 8.76224 7.08646 8.47637 14.5838 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 8.39335 12.3044 6.73466 4.48499 8.70827 10.214 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 8.39335 12.3044 6.73466 3.84261 9.86479 14.9274 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 6.02596 4.14427 6.10053 9.78119 9.33968 5.69354 numMergedOcc 0
9 mol 90 unq 1 iso 0 dist 8.17454 10.1669 6.10053 15.2751 9.33968 5.69354 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 8.65162 12.0992 8.14427 8.47587 8.98763 7.53105 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 8.94352 10.7499 8.76449 15.6431 9.28718 12.2295 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 8.0697 11.9696 8.95296 5.78025 7.33178 13.3477 numMergedOcc 0
13 mol 167 unq 1 iso 0 dist 8.0697 5.37536 6.10021 5.78025 7.33178 7.86284 numMergedOcc 0
14 mol 176 unq 0 iso 0 dist 8.00223 6.25297 7.26558 5.73429 5.58647 4.57491 numMergedOcc 0
15 mol 185 unq 0 iso 0 dist 8.60009 11.8032 8.07469 9.74741 8.22259 4.27185 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 8.20259 4.04112 9.49242 16.3871 9.41473 17.502 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 6.23243 4.12315 7.45831 7.44283 8.15802 3.76066 numMergedOcc 0
18 mol 254 unq 0 iso 0 dist 7.94753 4.93882 9.09568 7.97424 6.56151 9.71492 numMergedOcc 0
19 mol 254 unq 1 iso 0 dist 7.94753 4.93882 9.09568 4.18858 6.58752 8.60551 numMergedOcc 0
20 mol 254 unq 2 iso 0 dist 7.94753 5.60874 7.84221 7.97424 6.56151 3.58476 numMergedOcc 0
21 mol 254 unq 3 iso 0 dist 7.94753 5.60874 7.84221 4.18858 6.58752 7.04985 numMergedOcc 0
22 mol 254 unq 4 iso 0 dist 9.99046 4.93882 9.99168 7.97424 8.3417 9.71492 numMergedOcc 0
23 mol 254 unq 5 iso 0 dist 9.99046 5.60874 9.67383 7.97424 8.3417 3.58476 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 9.11501 12.3297 7.88108 4.21499 9.68243 10.7811 numMergedOcc 0
25 mol 274 unq 0 iso 0 dist 9.89615 12.1091 8.25703 16.53 8.87546 8.28273 numMergedOcc 0
26 mol 274 unq 1 iso 0 dist 5.77565 6.43955 8.25703 10.359 8.87546 8.28273 numMergedOcc 0
27 mol 283 unq 0 iso 0 dist 9.82274 11.2468 8.85163 14.2357 9.90494 3.27256 numMergedOcc 0
28 mol 283 unq 1 iso 0 dist 9.82274 11.2468 8.85163 7.50757 5.90121 10.2725 numMergedOcc 0
29 mol 283 unq 2 iso 0 dist 7.17276 5.70683 8.85163 8.40497 9.90494 3.27256 numMergedOcc 0
30 mol 283 unq 3 iso 0 dist 7.17276 5.70683 8.85163 8.03948 5.90121 10.2725 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 9.14217 10.3226 7.84189 7.76761 9.97939 14.42 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 9.14217 10.3226 7.84189 7.76761 9.97939 14.42 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 9.14217 10.3226 7.84189 7.76761 9.97939 14.42 numMergedOcc 0
