0 mol 11 unq 0 iso 0 dist 9.07476 5.8961 6.84216 6.65725 4.79838 8.05213 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.04534 5.71129 6.58046 6.35394 5.25331 7.85924 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 6.09533 6.47139 9.1397 5.867 8.09187 8.70343 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 4.90216 10.9658 8.30217 4.07863 7.92479 14.9359 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.4515 3.97569 6.23522 15.9672 7.78587 13.4082 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.4515 12.4903 9.10566 15.9672 7.78587 9.77992 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 8.4515 5.99117 9.62027 15.9672 7.78587 17.0996 numMergedOcc 0
7 mol 76 unq 0 iso 0 dist 6.46582 8.78063 7.61521 13.2281 8.90522 6.06861 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 8.48827 7.17843 7.91148 10.1263 7.03887 4.92509 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 8.03895 4.4651 7.91148 6.88255 7.03887 4.92509 numMergedOcc 0
10 mol 78 unq 2 iso 0 dist 7.14048 7.17843 6.59794 10.1263 5.36451 4.92509 numMergedOcc 0
11 mol 78 unq 3 iso 0 dist 5.68873 4.4651 6.59794 6.88255 5.36451 4.92509 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 9.48934 6.4437 9.3273 4.06022 9.68074 4.29204 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 6.41183 5.91683 9.3273 6.47962 9.68074 4.29204 numMergedOcc 0
14 mol 147 unq 0 iso 0 dist 8.76449 6.91778 6.73617 4.30798 9.23589 6.02355 numMergedOcc 0
15 mol 147 unq 1 iso 0 dist 8.36182 6.91778 9.03544 4.30798 9.22196 6.02355 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 8.26128 5.88662 8.89394 6.28784 5.97134 5.83431 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 8.17301 8.58814 9.70481 4.48609 7.61421 5.88819 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 8.1174 5.23741 8.08965 5.52698 9.11149 4.65302 numMergedOcc 0
19 mol 237 unq 0 iso 0 dist 7.69237 10.902 9.7255 8.90537 8.33629 6.56344 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 6.69951 8.70769 8.25897 7.53102 5.23503 4.99891 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 6.69951 8.70769 8.25897 6.58569 9.61028 5.32839 numMergedOcc 0
22 mol 265 unq 0 iso 0 dist 5.8898 5.75478 5.7944 5.55314 8.03604 6.43013 numMergedOcc 0
23 mol 265 unq 1 iso 0 dist 5.8898 5.75478 5.7944 6.97049 5.94614 5.51535 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 8.72101 4.88964 9.54359 13.2782 9.62597 10.7791 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 8.72101 6.76786 5.69112 13.2782 9.62597 6.58374 numMergedOcc 0
26 mol 277 unq 2 iso 0 dist 8.24013 10.9928 5.72327 4.29127 8.13595 8.91002 numMergedOcc 0
27 mol 277 unq 3 iso 0 dist 8.24013 10.8591 5.81301 4.29127 8.13595 8.34559 numMergedOcc 0
28 mol 277 unq 4 iso 0 dist 8.24013 12.5803 9.81201 4.29127 8.13595 8.76212 numMergedOcc 0
29 mol 277 unq 5 iso 0 dist 5.11998 14.2115 9.54359 13.8592 9.62597 10.7791 numMergedOcc 0
30 mol 277 unq 6 iso 0 dist 5.11998 10.8075 5.69112 13.8592 9.62597 6.58374 numMergedOcc 0
31 mol 281 unq 0 iso 0 dist 6.82918 7.74992 5.50053 13.607 9.94612 6.82073 numMergedOcc 0
32 mol 283 unq 0 iso 0 dist 9.35302 4.44211 9.07995 6.40657 9.06774 6.86733 numMergedOcc 0
33 mol 287 unq 0 iso 0 dist 9.1471 5.25853 9.18744 4.26276 7.77225 4.62998 numMergedOcc 0
34 mol 287 unq 1 iso 0 dist 7.84189 7.19628 5.30118 4.26276 5.50067 7.23534 numMergedOcc 0
35 mol 287 unq 2 iso 0 dist 7.84189 11.7959 8.98698 4.26276 5.50067 11.7115 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 9.1471 5.25853 9.18744 4.26276 7.77225 4.62998 numMergedOcc 0
37 mol 288 unq 1 iso 0 dist 7.84189 7.19628 5.30118 4.26276 5.50067 7.23534 numMergedOcc 0
38 mol 288 unq 2 iso 0 dist 7.84189 11.7959 8.98698 4.26276 5.50067 11.7115 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 9.1471 5.25853 9.18744 4.26276 7.77225 4.62998 numMergedOcc 0
40 mol 289 unq 1 iso 0 dist 7.84189 7.19628 5.30118 4.26276 5.50067 7.23534 numMergedOcc 0
41 mol 289 unq 2 iso 0 dist 7.84189 11.7959 8.98698 4.26276 5.50067 11.7115 numMergedOcc 0
