0 mol 14 unq 0 iso 0 dist 9.35488 4.92048 8.79533 14.4041 9.31271 16.5607 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 8.24798 5.3982 6.72533 4.25207 6.39243 4.96555 numMergedOcc 0
2 mol 18 unq 1 iso 0 dist 8.02079 5.3982 8.29216 4.25207 9.1715 4.96555 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 8.34361 4.94741 6.10175 13.2619 6.54183 10.1356 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 6.04611 7.25142 9.68277 7.85236 8.53393 9.74045 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 6.04611 7.25142 9.68277 9.299 5.57265 10.1493 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 9.56911 6.91704 8.39015 5.36296 8.44515 10.4263 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 7.68053 7.84652 8.39015 4.8042 8.44515 10.4263 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 9.03472 8.39416 4.85152 4.56886 5.90776 6.82886 numMergedOcc 0
9 mol 92 unq 1 iso 0 dist 9.40274 10.4946 4.85152 5.1219 5.90776 6.82886 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 8.04448 10.9027 3.59451 8.91618 6.78839 9.30656 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 8.04448 10.9027 3.59451 14.8024 8.02354 5.39087 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 8.85708 8.3896 5.24519 4.60144 8.81172 6.29427 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 8.27253 4.07356 9.07096 10.7421 7.85527 11.2951 numMergedOcc 0
14 mol 125 unq 0 iso 0 dist 8.12448 5.49502 9.64304 4.71345 6.03557 9.19339 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 8.53875 16.3227 9.98097 12.0003 7.97349 7.20524 numMergedOcc 0
16 mol 199 unq 0 iso 0 dist 9.61894 5.74514 7.29716 9.18139 9.30897 4.26752 numMergedOcc 0
17 mol 199 unq 1 iso 0 dist 9.61894 5.8827 8.80983 9.18139 9.30897 12.1142 numMergedOcc 0
18 mol 212 unq 0 iso 0 dist 8.85976 5.08998 6.41916 14.7053 9.47932 9.7586 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 7.43427 6.86057 5.98076 5.53181 4.851 8.31343 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 7.50841 12.1138 5.98076 5.02331 4.851 8.31343 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 8.18597 7.03513 7.99145 5.92777 7.71761 11.4528 numMergedOcc 0
22 mol 230 unq 0 iso 0 dist 8.95575 4.35944 5.00735 8.898 5.62804 7.07028 numMergedOcc 0
23 mol 230 unq 1 iso 0 dist 8.95575 4.35944 5.00735 12.5509 9.3619 11.491 numMergedOcc 0
24 mol 230 unq 2 iso 0 dist 8.95575 5.31386 6.73755 8.898 5.62804 5.26217 numMergedOcc 0
25 mol 230 unq 3 iso 0 dist 8.95575 5.31386 6.73755 12.5509 9.3619 7.46522 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 9.87224 7.04644 4.21935 9.86326 6.83046 5.29737 numMergedOcc 0
27 mol 256 unq 0 iso 0 dist 8.88264 9.7941 8.11884 6.4717 5.98967 9.07441 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 6.41167 3.95075 6.59521 7.52881 8.21585 9.22664 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 5.16838 5.45575 7.4294 4.62072 5.75874 6.9607 numMergedOcc 0
30 mol 259 unq 1 iso 0 dist 5.16838 10.6997 8.37253 4.62072 5.75874 6.68041 numMergedOcc 0
31 mol 266 unq 0 iso 0 dist 4.88541 4.90213 6.35457 4.38226 9.07043 5.73592 numMergedOcc 0
32 mol 274 unq 0 iso 0 dist 7.03782 11.0932 8.26695 4.4049 5.82876 12.0757 numMergedOcc 0
33 mol 274 unq 1 iso 0 dist 7.03782 11.0932 8.26695 10.4747 8.71129 16.0765 numMergedOcc 0
34 mol 274 unq 2 iso 0 dist 7.03782 5.66978 5.59151 4.4049 5.82876 7.96313 numMergedOcc 0
35 mol 274 unq 3 iso 0 dist 7.03782 5.66978 5.59151 10.4747 8.71129 13.1879 numMergedOcc 0
36 mol 274 unq 4 iso 0 dist 7.03782 10.88 8.17922 4.4049 5.82876 7.97998 numMergedOcc 0
37 mol 274 unq 5 iso 0 dist 7.03782 10.88 8.17922 10.4747 8.71129 5.7745 numMergedOcc 0
38 mol 277 unq 0 iso 0 dist 7.91992 8.78001 8.83777 10.8591 7.07459 12.7283 numMergedOcc 0
39 mol 277 unq 1 iso 0 dist 7.91992 4.54209 9.42812 10.8591 7.07459 13.8339 numMergedOcc 0
40 mol 279 unq 0 iso 0 dist 8.8643 6.17316 8.36655 7.84864 8.68797 5.34376 numMergedOcc 0
41 mol 279 unq 1 iso 0 dist 9.24895 7.88157 8.76889 4.79698 5.70546 9.36068 numMergedOcc 0
42 mol 279 unq 2 iso 0 dist 9.24895 8.60764 6.37469 4.79698 5.70546 5.13535 numMergedOcc 0
43 mol 279 unq 3 iso 0 dist 8.34154 12.3885 8.76889 10.5081 5.70546 9.36068 numMergedOcc 0
44 mol 279 unq 4 iso 0 dist 8.34154 6.66489 6.37469 10.5081 5.70546 5.13535 numMergedOcc 0
45 mol 279 unq 5 iso 0 dist 5.90456 12.8668 8.36655 11.6042 8.68797 5.34376 numMergedOcc 0
46 mol 280 unq 0 iso 0 dist 4.26671 10.0698 9.047 10.0206 8.80588 14.1091 numMergedOcc 0
47 mol 280 unq 1 iso 0 dist 4.26671 11.2544 9.9227 10.0206 8.80588 4.95798 numMergedOcc 0
