0 mol 2 unq 0 iso 0 dist 5.42021 9.10747 5.66327 6.93149 9.78005 11.5931 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 5.42021 9.10747 5.66327 4.00237 6.89072 11.5162 numMergedOcc 0
2 mol 2 unq 2 iso 0 dist 5.42021 9.45683 5.6648 6.93149 9.78005 15.1994 numMergedOcc 0
3 mol 2 unq 3 iso 0 dist 5.42021 9.45683 5.6648 4.00237 6.89072 8.38173 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.6112 6.73259 6.29311 7.07479 7.89667 10.8239 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.74131 5.69384 6.32618 7.37828 9.853 10.7983 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.59503 8.95651 7.34488 8.46944 5.04673 10.2292 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 9.64281 6.20553 5.12275 3.77247 9.86767 8.28325 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 8.43293 9.27951 4.63594 3.71884 8.03124 10.2198 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 7.12336 7.34386 11.3259 5.56456 8.52036 10.5111 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 7.5447 6.0247 3.64474 15.4278 9.37245 12.2996 numMergedOcc 0
11 mol 169 unq 0 iso 0 dist 9.83308 6.29631 5.42467 3.89732 9.58901 8.21203 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 7.4839 9.8594 9.36957 7.59772 8.13136 15.7814 numMergedOcc 0
13 mol 176 unq 1 iso 0 dist 9.70481 8.25343 9.26877 6.25591 8.13136 12.2795 numMergedOcc 0
14 mol 176 unq 2 iso 0 dist 6.59532 8.86094 9.26877 3.47653 8.13136 12.2795 numMergedOcc 0
15 mol 183 unq 0 iso 0 dist 8.15747 8.23616 9.81254 13.3248 7.16035 16.8131 numMergedOcc 0
16 mol 183 unq 1 iso 0 dist 8.15747 8.23616 9.81254 9.03854 6.2675 13.8172 numMergedOcc 0
17 mol 183 unq 2 iso 0 dist 8.74903 8.23616 9.58361 13.3248 9.61725 16.8131 numMergedOcc 0
18 mol 183 unq 3 iso 0 dist 8.74903 8.23616 9.58361 9.03854 9.52042 13.8172 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 5.29561 9.49955 8.67887 5.28999 9.4726 12.12 numMergedOcc 0
20 mol 232 unq 1 iso 0 dist 5.29561 7.03236 7.67378 5.28999 9.4726 6.19029 numMergedOcc 0
21 mol 232 unq 2 iso 0 dist 9.16638 9.49955 5.06557 5.28999 9.33969 12.12 numMergedOcc 0
22 mol 232 unq 3 iso 0 dist 9.16638 9.49955 5.06557 10.1458 7.64079 9.67093 numMergedOcc 0
23 mol 232 unq 4 iso 0 dist 9.16638 7.03236 5.42475 5.28999 9.33969 6.19029 numMergedOcc 0
24 mol 232 unq 5 iso 0 dist 9.16638 7.03236 5.42475 10.1458 7.64079 10.6339 numMergedOcc 0
25 mol 233 unq 0 iso 0 dist 9.06304 8.35521 9.14406 8.15592 7.40498 9.89428 numMergedOcc 0
26 mol 253 unq 0 iso 0 dist 5.86892 8.95991 5.57882 11.1928 8.71119 11.3749 numMergedOcc 0
27 mol 253 unq 1 iso 0 dist 5.86892 8.95991 5.57882 6.55091 6.21648 11.7262 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 8.12306 6.89391 13.3596 5.00843 6.73396 11.8916 numMergedOcc 0
29 mol 286 unq 0 iso 0 dist 5.03123 7.77655 7.28845 9.30848 8.87916 13.7414 numMergedOcc 0
30 mol 286 unq 1 iso 0 dist 5.03123 7.77655 7.28845 3.90927 8.27359 11.0082 numMergedOcc 0
31 mol 286 unq 2 iso 0 dist 5.03123 7.77655 7.28845 3.85003 8.14957 7.43339 numMergedOcc 0
