0 mol 26 unq 0 iso 0 dist 6.40556 6.84156 5.272 3.72629 5.92521 8.5973 numMergedOcc 0
1 mol 26 unq 0 iso 1 dist 5.272 6.84156 6.40556 8.5973 5.92521 3.72629 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 6.40556 6.84156 5.272 4.01424 7.97592 7.51191 numMergedOcc 0
3 mol 26 unq 1 iso 1 dist 5.272 6.84156 6.40556 7.51191 7.97592 4.01424 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.02004 10.2386 6.35042 3.47529 9.54119 12.4809 numMergedOcc 0
5 mol 48 unq 0 iso 1 dist 6.35042 10.2386 8.02004 12.4809 9.54119 3.47529 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 8.02004 10.2386 6.35042 13.1138 7.87476 4.67004 numMergedOcc 0
7 mol 48 unq 1 iso 1 dist 6.35042 10.2386 8.02004 4.67004 7.87476 13.1138 numMergedOcc 0
8 mol 48 unq 2 iso 0 dist 7.77714 10.6687 6.46118 3.42062 9.77004 12.971 numMergedOcc 0
9 mol 48 unq 2 iso 1 dist 6.46118 10.6687 7.77714 12.971 9.77004 3.42062 numMergedOcc 0
10 mol 48 unq 3 iso 0 dist 7.77714 10.6687 6.46118 13.5492 8.36323 4.70736 numMergedOcc 0
11 mol 48 unq 3 iso 1 dist 6.46118 10.6687 7.77714 4.70736 8.36323 13.5492 numMergedOcc 0
12 mol 55 unq 0 iso 0 dist 6.71884 15.4294 9.25575 9.96122 9.07741 13.0046 numMergedOcc 0
13 mol 55 unq 0 iso 1 dist 9.25575 15.4294 6.71884 13.0046 9.07741 9.96122 numMergedOcc 0
14 mol 55 unq 1 iso 0 dist 6.71884 15.4294 9.25575 5.32648 8.0388 14.8358 numMergedOcc 0
15 mol 55 unq 1 iso 1 dist 9.25575 15.4294 6.71884 14.8358 8.0388 5.32648 numMergedOcc 0
16 mol 55 unq 2 iso 0 dist 6.71884 15.4294 9.25575 12.7872 9.7883 9.78627 numMergedOcc 0
17 mol 55 unq 2 iso 1 dist 9.25575 15.4294 6.71884 9.78627 9.7883 12.7872 numMergedOcc 0
18 mol 58 unq 0 iso 0 dist 6.89262 5.11838 6.50646 11.6207 9.78668 6.85539 numMergedOcc 0
19 mol 58 unq 0 iso 1 dist 6.50646 5.11838 6.89262 6.85539 9.78668 11.6207 numMergedOcc 0
20 mol 176 unq 0 iso 0 dist 6.02559 10.7245 8.12047 3.71345 7.69241 11.1744 numMergedOcc 0
21 mol 176 unq 0 iso 1 dist 8.12047 10.7245 6.02559 11.1744 7.69241 3.71345 numMergedOcc 0
22 mol 176 unq 1 iso 0 dist 6.02559 10.7245 8.12047 12.3716 8.56192 11.8836 numMergedOcc 0
23 mol 176 unq 1 iso 1 dist 8.12047 10.7245 6.02559 11.8836 8.56192 12.3716 numMergedOcc 0
24 mol 176 unq 2 iso 0 dist 6.02559 10.7245 8.12047 8.25138 7.77962 3.52268 numMergedOcc 0
25 mol 176 unq 2 iso 1 dist 8.12047 10.7245 6.02559 3.52268 7.77962 8.25138 numMergedOcc 0
26 mol 176 unq 3 iso 0 dist 6.02559 10.7245 8.12047 7.10617 8.6431 7.39809 numMergedOcc 0
27 mol 176 unq 3 iso 1 dist 8.12047 10.7245 6.02559 7.39809 8.6431 7.10617 numMergedOcc 0
28 mol 184 unq 0 iso 0 dist 8.57284 7.47996 5.34832 5.65165 8.98606 10.8625 numMergedOcc 0
29 mol 184 unq 0 iso 1 dist 5.34832 7.47996 8.57284 10.8625 8.98606 5.65165 numMergedOcc 0
30 mol 257 unq 0 iso 0 dist 8.42116 4.45719 8.53984 6.38688 9.95749 5.78703 numMergedOcc 0
31 mol 257 unq 0 iso 1 dist 8.53984 4.45719 8.42116 5.78703 9.95749 6.38688 numMergedOcc 0
32 mol 265 unq 0 iso 0 dist 5.81967 3.62968 9.19106 3.42654 5.14151 5.12694 numMergedOcc 0
33 mol 265 unq 0 iso 1 dist 9.19106 3.62968 5.81967 5.12694 5.14151 3.42654 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 6.87275 6.51903 7.02416 4.32613 7.45915 3.64811 numMergedOcc 0
35 mol 278 unq 0 iso 1 dist 7.02416 6.51903 6.87275 3.64811 7.45915 4.32613 numMergedOcc 0
36 mol 292 unq 0 iso 0 dist 9.83077 8.46494 8.45634 13.986 7.89784 11.1761 numMergedOcc 0
37 mol 292 unq 0 iso 1 dist 8.45634 8.46494 9.83077 11.1761 7.89784 13.986 numMergedOcc 0
