0 mol 7 unq 0 iso 0 dist 9.34656 15.0884 6.36911 17.5535 9.97624 5.03847 16.3136 8.81608 6.88805 5.5683 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.34656 6.3236 9.36807 17.5535 9.97624 13.8829 16.3136 8.81608 13.156 5.5683 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.25905 7.43559 8.52106 15.137 8.80193 10.6757 16.1629 9.35863 11.5747 3.84273 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 8.25905 7.43559 8.52106 15.137 8.80193 10.6757 6.82841 5.04478 6.11048 11.0746 numMergedOcc 0
4 mol 18 unq 2 iso 0 dist 8.25905 10.1793 6.32451 15.137 8.80193 7.62011 16.1629 9.35863 6.96996 3.84273 numMergedOcc 0
5 mol 18 unq 3 iso 0 dist 8.25905 10.1793 6.32451 15.137 8.80193 7.62011 6.82841 5.04478 4.52259 11.0746 numMergedOcc 0
6 mol 21 unq 0 iso 0 dist 4.82549 6.5268 6.08338 7.9574 6.93185 10.6971 10.0518 9.35562 14.0241 3.76294 numMergedOcc 0
7 mol 21 unq 1 iso 0 dist 4.82549 6.5268 6.08338 7.9574 6.93185 10.6971 6.53652 8.63857 4.20001 12.9404 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.94447 12.7099 6.81812 15.0577 7.33541 9.76608 11.2557 5.29949 8.50705 11.0969 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 5.43229 5.98221 7.76729 11.6661 7.70313 14.0688 9.02908 8.0168 6.63111 10.3264 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 6.35364 8.50279 7.75534 11.4029 7.36017 6.0268 10.6053 8.7789 5.42561 3.9234 numMergedOcc 0
11 mol 126 unq 1 iso 0 dist 6.35364 8.50279 7.75534 11.4029 7.36017 6.0268 13.8413 9.93613 10.7549 5.50104 numMergedOcc 0
12 mol 126 unq 2 iso 0 dist 6.35364 8.50279 7.75534 7.05454 5.14819 8.01268 10.6053 8.7789 5.42561 6.1079 numMergedOcc 0
13 mol 126 unq 3 iso 0 dist 6.35364 8.50279 7.75534 7.05454 5.14819 8.01268 13.8413 9.93613 10.7549 7.02562 numMergedOcc 0
14 mol 126 unq 4 iso 0 dist 6.35364 8.50279 7.75534 4.95023 6.84245 10.2072 10.6053 8.7789 5.42561 9.58426 numMergedOcc 0
15 mol 126 unq 5 iso 0 dist 6.35364 8.50279 7.75534 4.95023 6.84245 10.2072 13.8413 9.93613 10.7549 11.1195 numMergedOcc 0
16 mol 126 unq 6 iso 0 dist 6.35364 5.68478 9.06011 11.4029 7.36017 10.1326 10.6053 8.7789 7.47528 3.9234 numMergedOcc 0
17 mol 126 unq 7 iso 0 dist 6.35364 5.68478 9.06011 11.4029 7.36017 10.1326 13.8413 9.93613 11.9496 5.50104 numMergedOcc 0
18 mol 126 unq 8 iso 0 dist 6.35364 5.68478 9.06011 7.05454 5.14819 6.51507 10.6053 8.7789 7.47528 6.1079 numMergedOcc 0
19 mol 126 unq 9 iso 0 dist 6.35364 5.68478 9.06011 7.05454 5.14819 6.51507 13.8413 9.93613 11.9496 7.02562 numMergedOcc 0
20 mol 126 unq 10 iso 0 dist 6.35364 5.68478 9.06011 4.95023 6.84245 5.78149 10.6053 8.7789 7.47528 9.58426 numMergedOcc 0
21 mol 126 unq 11 iso 0 dist 6.35364 5.68478 9.06011 4.95023 6.84245 5.78149 13.8413 9.93613 11.9496 11.1195 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 9.59094 11.0811 7.92688 12.0166 6.51868 5.92062 13.2035 9.10003 14.8533 10.0161 numMergedOcc 0
23 mol 133 unq 1 iso 0 dist 9.59094 11.0811 7.92688 5.14992 7.34698 6.61891 13.2035 9.10003 14.8533 11.7838 numMergedOcc 0
24 mol 143 unq 0 iso 0 dist 7.13287 5.01665 7.31468 11.3048 6.46089 10.0059 9.1255 7.05845 7.63293 12.207 numMergedOcc 0
25 mol 143 unq 1 iso 0 dist 7.13287 4.9475 7.7056 11.3048 6.46089 8.57817 9.1255 7.05845 11.903 12.207 numMergedOcc 0
26 mol 225 unq 0 iso 0 dist 6.31342 6.9955 5.50387 7.13133 9.47117 8.32583 4.94099 5.93063 4.7456 10.1358 numMergedOcc 0
27 mol 235 unq 0 iso 0 dist 9.24964 6.70342 9.58736 13.9329 7.31773 15.6327 9.94369 7.02029 13.7306 5.4263 numMergedOcc 0
28 mol 235 unq 1 iso 0 dist 9.24964 6.38281 9.43058 13.9329 7.31773 10.632 9.94369 7.02029 7.31605 5.4263 numMergedOcc 0
29 mol 235 unq 2 iso 0 dist 9.24964 10.6146 8.75735 13.9329 7.31773 6.01041 9.94369 7.02029 4.12497 5.4263 numMergedOcc 0
30 mol 235 unq 3 iso 0 dist 9.24964 14.8599 6.98084 13.9329 7.31773 6.82855 9.94369 7.02029 8.26028 5.4263 numMergedOcc 0
31 mol 235 unq 4 iso 0 dist 9.24964 16.2392 7.32211 13.9329 7.31773 6.46722 9.94369 7.02029 10.7187 5.4263 numMergedOcc 0
32 mol 235 unq 5 iso 0 dist 5.71896 6.01036 9.58736 10.1328 7.31773 15.6327 7.91326 7.02029 13.7306 5.4263 numMergedOcc 0
33 mol 235 unq 6 iso 0 dist 5.71896 4.99641 9.43058 10.1328 7.31773 10.632 7.91326 7.02029 7.31605 5.4263 numMergedOcc 0
34 mol 235 unq 7 iso 0 dist 5.71896 7.72505 8.75735 10.1328 7.31773 6.01041 7.91326 7.02029 4.12497 5.4263 numMergedOcc 0
35 mol 235 unq 8 iso 0 dist 5.71896 12.2179 6.98084 10.1328 7.31773 6.82855 7.91326 7.02029 8.26028 5.4263 numMergedOcc 0
36 mol 235 unq 9 iso 0 dist 5.71896 11.7282 7.32211 10.1328 7.31773 6.46722 7.91326 7.02029 10.7187 5.4263 numMergedOcc 0
37 mol 235 unq 10 iso 0 dist 8.3229 17.1296 9.58736 6.43382 7.31773 15.6327 5.72513 7.02029 13.7306 5.4263 numMergedOcc 0
38 mol 235 unq 11 iso 0 dist 8.3229 12.86 9.43058 6.43382 7.31773 10.632 5.72513 7.02029 7.31605 5.4263 numMergedOcc 0
39 mol 235 unq 12 iso 0 dist 8.3229 9.39763 8.75735 6.43382 7.31773 6.01041 5.72513 7.02029 4.12497 5.4263 numMergedOcc 0
40 mol 235 unq 13 iso 0 dist 8.3229 4.29928 6.98084 6.43382 7.31773 6.82855 5.72513 7.02029 8.26028 5.4263 numMergedOcc 0
41 mol 235 unq 14 iso 0 dist 8.3229 10.1212 7.32211 6.43382 7.31773 6.46722 5.72513 7.02029 10.7187 5.4263 numMergedOcc 0
42 mol 267 unq 0 iso 0 dist 6.87713 11.9598 8.76007 15.4443 9.01354 9.33806 5.30771 6.32877 11.5903 14.8427 numMergedOcc 0
43 mol 267 unq 1 iso 0 dist 6.87713 11.9598 8.76007 15.4443 9.01354 9.33806 7.81198 9.48115 9.15724 16.1143 numMergedOcc 0
44 mol 267 unq 2 iso 0 dist 6.87713 11.9598 8.76007 15.4443 9.01354 9.33806 14.1912 8.38545 5.65969 5.32312 numMergedOcc 0
45 mol 267 unq 3 iso 0 dist 6.87713 11.9598 8.76007 15.4443 9.01354 9.33806 10.6273 5.08174 9.22276 5.68457 numMergedOcc 0
46 mol 267 unq 4 iso 0 dist 6.87713 11.9598 8.76007 15.4443 9.01354 9.33806 11.0675 6.10838 6.06209 5.41564 numMergedOcc 0
47 mol 267 unq 5 iso 0 dist 8.87518 9.77423 8.76007 8.08702 9.01354 9.33806 11.6034 6.32877 11.5903 14.8427 numMergedOcc 0
48 mol 267 unq 6 iso 0 dist 8.87518 9.77423 8.76007 8.08702 9.01354 9.33806 12.9552 9.48115 9.15724 16.1143 numMergedOcc 0
49 mol 267 unq 7 iso 0 dist 8.87518 9.77423 8.76007 8.08702 9.01354 9.33806 5.23612 8.38545 5.65969 5.32312 numMergedOcc 0
50 mol 267 unq 8 iso 0 dist 8.87518 9.77423 8.76007 8.08702 9.01354 9.33806 10.1261 5.08174 9.22276 5.68457 numMergedOcc 0
51 mol 267 unq 9 iso 0 dist 8.87518 9.77423 8.76007 8.08702 9.01354 9.33806 9.74815 6.10838 6.06209 5.41564 numMergedOcc 0
52 mol 274 unq 0 iso 0 dist 8.38395 6.45522 9.19234 9.16187 9.20749 5.64601 11.3961 6.66172 8.87855 5.39432 numMergedOcc 0
