0 mol 24 unq 0 iso 0 dist 6.86014 9.75144 5.39241 9.61998 7.72775 5.09339 7.49157 8.66248 6.72423 4.48908 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.86014 9.75144 5.39241 9.61998 7.72775 5.09339 7.73794 6.73521 4.0664 5.73289 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.34347 6.73162 7.23546 7.47201 9.49511 7.38466 7.98005 12.5438 8.62111 13.859 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.34347 6.73162 7.23546 7.47201 9.49511 7.38466 8.31381 8.39015 9.18438 14.2723 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.80331 9.83618 10.4442 6.79185 11.1338 6.17433 9.02471 12.6657 10.4465 11.9382 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 6.20293 9.83618 9.49077 6.79185 5.54797 6.17433 9.02471 14.0654 10.4465 11.9382 numMergedOcc 0
6 mol 52 unq 0 iso 0 dist 9.80098 7.18176 5.93337 5.75761 6.55615 8.12937 6.22221 8.88455 6.35905 8.15965 numMergedOcc 0
7 mol 52 unq 1 iso 0 dist 7.34143 7.18176 4.5482 5.75761 9.64358 8.12937 6.22221 9.53385 6.35905 8.15965 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 8.8178 6.77912 12.0644 8.96978 8.39969 6.33215 4.86198 5.21565 10.4337 9.59421 numMergedOcc 0
9 mol 72 unq 1 iso 0 dist 9.96708 6.77912 7.11552 8.96978 4.45372 6.33215 4.86198 10.7434 10.4337 9.59421 numMergedOcc 0
10 mol 88 unq 0 iso 0 dist 9.36773 8.66514 8.4283 6.066 6.81076 7.39092 9.07128 10.8406 3.99025 10.2678 numMergedOcc 0
11 mol 88 unq 1 iso 0 dist 9.36773 8.66514 8.4283 6.066 6.81076 7.39092 6.65615 4.47193 6.69123 7.1811 numMergedOcc 0
12 mol 88 unq 2 iso 0 dist 9.36773 9.25235 5.37521 6.066 6.81076 8.30564 9.07128 10.8406 6.08504 10.2678 numMergedOcc 0
13 mol 88 unq 3 iso 0 dist 9.36773 9.25235 5.37521 6.066 6.81076 8.30564 6.65615 4.47193 3.77436 7.1811 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 8.14887 8.59981 14.9761 5.72373 10.2773 4.98036 5.39356 10.2024 6.92548 3.76048 numMergedOcc 0
15 mol 127 unq 1 iso 0 dist 8.14887 8.59981 14.9761 5.72373 10.2773 4.98036 9.92746 5.4328 16.8777 12.308 numMergedOcc 0
16 mol 127 unq 2 iso 0 dist 8.14887 7.34519 7.41404 5.72373 10.2773 8.57565 5.39356 10.2024 5.87751 3.76048 numMergedOcc 0
17 mol 127 unq 3 iso 0 dist 8.14887 7.34519 7.41404 5.72373 10.2773 8.57565 9.92746 5.4328 5.08112 12.308 numMergedOcc 0
18 mol 127 unq 4 iso 0 dist 9.30299 8.59981 14.085 5.72373 10.7123 4.98036 5.39356 12.7606 6.92548 3.76048 numMergedOcc 0
19 mol 127 unq 5 iso 0 dist 9.30299 8.59981 14.085 5.72373 10.7123 4.98036 9.92746 12.6193 16.8777 12.308 numMergedOcc 0
20 mol 127 unq 6 iso 0 dist 9.30299 7.34519 13.1312 5.72373 10.7123 8.57565 5.39356 12.7606 5.87751 3.76048 numMergedOcc 0
21 mol 127 unq 7 iso 0 dist 9.30299 7.34519 13.1312 5.72373 10.7123 8.57565 9.92746 12.6193 5.08112 12.308 numMergedOcc 0
22 mol 132 unq 0 iso 0 dist 7.7059 6.03703 9.92344 7.19937 10.8443 6.73645 5.77186 6.85721 5.82383 4.14654 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 7.81386 7.98142 9.53462 8.47008 7.45927 5.3049 8.29467 6.13927 9.55459 10.8158 numMergedOcc 0
24 mol 181 unq 1 iso 0 dist 7.81386 7.37327 11.1462 8.47008 7.45927 10.8044 8.29467 6.13927 7.66761 10.8158 numMergedOcc 0
25 mol 181 unq 2 iso 0 dist 7.63312 7.98142 9.60512 8.47008 5.83639 5.3049 8.29467 13.2274 9.55459 10.8158 numMergedOcc 0
26 mol 181 unq 3 iso 0 dist 7.63312 7.37327 13.3389 8.47008 5.83639 10.8044 8.29467 13.2274 7.66761 10.8158 numMergedOcc 0
27 mol 256 unq 0 iso 0 dist 8.29103 5.24676 4.22352 9.72168 12.0476 9.71947 4.80903 5.08421 3.89364 12.6385 numMergedOcc 0
