0 mol 70 unq 0 iso 0 dist 9.74268 10.7301 7.92394 11.7565 9.93423 4.25121 numMergedOcc 0
1 mol 70 unq 0 iso 1 dist 9.74268 11.7565 9.93423 10.7301 7.92394 4.25121 numMergedOcc 0
2 mol 70 unq 1 iso 0 dist 9.74268 10.7301 7.92394 12.3296 9.34122 13.6636 numMergedOcc 0
3 mol 70 unq 1 iso 1 dist 9.74268 12.3296 9.34122 10.7301 7.92394 13.6636 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 9.74268 11.7565 9.93423 12.3296 9.34122 12.434 numMergedOcc 0
5 mol 70 unq 1 iso 1 dist 9.74268 12.3296 9.34122 11.7565 9.93423 12.434 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.28737 8.66353 8.97793 12.2209 8.19682 5.67347 numMergedOcc 0
7 mol 76 unq 0 iso 1 dist 8.28737 12.2209 8.19682 8.66353 8.97793 5.67347 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.32004 5.66952 9.38288 4.91188 6.19042 6.59581 numMergedOcc 0
9 mol 119 unq 0 iso 1 dist 8.32004 4.91188 6.19042 5.66952 9.38288 6.59581 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 8.32004 5.66952 9.38288 7.01214 7.44174 11.6138 numMergedOcc 0
11 mol 119 unq 1 iso 1 dist 8.32004 7.01214 7.44174 5.66952 9.38288 11.6138 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 8.32004 4.91188 6.19042 7.01214 7.44174 8.58342 numMergedOcc 0
13 mol 119 unq 1 iso 1 dist 8.32004 7.01214 7.44174 4.91188 6.19042 8.58342 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 9.79448 11.8721 8.59981 11.5439 7.34519 12.7129 numMergedOcc 0
15 mol 127 unq 0 iso 1 dist 9.79448 11.5439 7.34519 11.8721 8.59981 12.7129 numMergedOcc 0
16 mol 155 unq 0 iso 0 dist 8.14907 7.79621 7.39644 6.3186 7.70572 9.42764 numMergedOcc 0
17 mol 155 unq 0 iso 1 dist 8.14907 6.3186 7.70572 7.79621 7.39644 9.42764 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 9.25528 14.3955 6.94688 15.6271 6.71012 5.3528 numMergedOcc 0
19 mol 181 unq 0 iso 1 dist 9.25528 15.6271 6.71012 14.3955 6.94688 5.3528 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 6.82185 10.693 6.0965 12.9129 9.59129 6.04429 numMergedOcc 0
21 mol 213 unq 0 iso 1 dist 6.82185 12.9129 9.59129 10.693 6.0965 6.04429 numMergedOcc 0
22 mol 213 unq 1 iso 0 dist 6.77104 9.7466 6.68292 5.52154 4.26212 4.8814 numMergedOcc 0
23 mol 213 unq 1 iso 1 dist 6.77104 5.52154 4.26212 9.7466 6.68292 4.8814 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 6.83122 8.77336 6.97182 10.8541 6.1175 5.93129 numMergedOcc 0
25 mol 214 unq 0 iso 1 dist 6.83122 10.8541 6.1175 8.77336 6.97182 5.93129 numMergedOcc 0
26 mol 218 unq 0 iso 0 dist 5.52981 10.2333 7.18041 6.48676 7.17547 9.17818 numMergedOcc 0
27 mol 218 unq 0 iso 1 dist 5.52981 6.48676 7.17547 10.2333 7.18041 9.17818 numMergedOcc 0
28 mol 218 unq 1 iso 0 dist 6.22077 6.21463 9.50586 6.48676 7.13323 4.63933 numMergedOcc 0
29 mol 218 unq 1 iso 1 dist 6.22077 6.48676 7.13323 6.21463 9.50586 4.63933 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 7.62771 12.4266 9.68513 11.091 5.9216 4.83721 numMergedOcc 0
31 mol 238 unq 0 iso 1 dist 7.62771 11.091 5.9216 12.4266 9.68513 4.83721 numMergedOcc 0
32 mol 272 unq 0 iso 0 dist 7.66615 6.68919 9.09992 8.13036 6.16449 9.75529 numMergedOcc 0
33 mol 272 unq 0 iso 1 dist 7.66615 8.13036 6.16449 6.68919 9.09992 9.75529 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 7.28096 9.67343 7.04472 6.32031 6.4778 11.01 numMergedOcc 0
35 mol 287 unq 0 iso 1 dist 7.28096 6.32031 6.4778 9.67343 7.04472 11.01 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 7.28096 9.67343 7.04472 6.32031 6.4778 11.01 numMergedOcc 0
37 mol 288 unq 0 iso 1 dist 7.28096 6.32031 6.4778 9.67343 7.04472 11.01 numMergedOcc 0
38 mol 289 unq 0 iso 0 dist 7.28096 9.67343 7.04472 6.32031 6.4778 11.01 numMergedOcc 0
39 mol 289 unq 0 iso 1 dist 7.28096 6.32031 6.4778 9.67343 7.04472 11.01 numMergedOcc 0
